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Bonds types in CCCBDB

This table lists the bond types and how many molecules with each bond type are in the CCCBDB. Examples
C-CCarbon carbon single bond
C=CCarbon carbon double bond
C#CCarbon carbon triple bond
C:CCarbon carbon aromatic bond
H.OHyrdogen bond
The bonds are listed with the lowest atomic number first and then sorted alphabetically. For example Al-H is listed as H-Al.
Click on the species for the experimental data.
Bond type Quantity Typical Species List all species Experimental data
Al#Al 1 Al2-   Experimental data
Al#P 1 AlP   Experimental data
Al=S 2 AlS+ List all species Experimental data
Al-Al 3 Al2H6 List all species Experimental data
Al-Cl 7 AlFCl2 List all species Experimental data
Al-Ga 1 AlGa   Experimental data
Al-S 1 AlS   Experimental data
Ar-Ar 2 Ar2+ List all species Experimental data
As-As 2 As4 List all species Experimental data
B#N 1 BN   Experimental data
B#O 1 BO-   Experimental data
B#P 1 BP   Experimental data
B:N 1 B3N3H6   Experimental data
B=C 3 CH2BOH List all species Experimental data
B=F 2 BF+ List all species Experimental data
B=N 2 BN+ List all species Experimental data
B=O 4 HBO List all species Experimental data
B=S 3 HBS List all species Experimental data
B-Al 1 BAl   Experimental data
B-B 9 HBHHBH List all species Experimental data
B-Br 2 BBr3 List all species Experimental data
B-C 5 CH3BO List all species Experimental data
B-Cl 6 BHCl2 List all species Experimental data
Be=F 1 BeF+   Experimental data
Be=N 2 BeN- List all species Experimental data
Be=O 3 BeO+ List all species Experimental data
Be=S 2 BeS+ List all species Experimental data
Be-B 1 BeB   Experimental data
Be-Be 3 Be2+ List all species Experimental data
Be-C 1 BeC   Experimental data
Be-Cl 4 BeCl2 List all species Experimental data
Be-F 3 BeF2 List all species Experimental data
Be-Mg 1 BeMg   Experimental data
Be-N 1 BeN+   Experimental data
Be-Na 1 NaBe   Experimental data
Be-O 2 BeOH List all species Experimental data
Be-S 1 BeS   Experimental data
B-F 8 NH3BF3 List all species Experimental data
B-Ga 1 BGa   Experimental data
B-N 3 NH3BF3 List all species Experimental data
B-O 5 H3BO3 List all species Experimental data
Br-Br 3 Br2+ List all species Experimental data
Br-I 1 IBr   Experimental data
B-S 1 BS   Experimental data
C#C 41 NH2CCNH2 List all species Experimental data
C#N 58 ZnCN List all species Experimental data
C#O 4 Fe(CO)5 List all species Experimental data
C#P 4 HCP List all species Experimental data
C#S 1 HCS+   Experimental data
C:C 59 Fe(C5H5)2 List all species Experimental data
C:N 13 C6H7N List all species Experimental data
C=Al 1 AlC   Experimental data
C=C 236 HOCHCCHOH List all species Experimental data
C=F 2 CF+ List all species Experimental data
C=Ge 1 GeC   Experimental data
C=N 55 NHCHNH2 List all species Experimental data
C=O 172 OCSe List all species Experimental data
C=P 2 PF3CH2 List all species Experimental data
C=S 21 OCS+ List all species Experimental data
C=Se 4 OCSe List all species Experimental data
C=Si 4 SiC+ List all species Experimental data
Ca-Ca 1 Ca2   Experimental data
C-Al 1 Al(CH3)3   Experimental data
C-As 1 As(CH3)3   Experimental data
C-Br 28 COHBr List all species Experimental data
C-C 543 NH2COOC2H5 List all species Experimental data
C-Cl 112 SiH3CCl3 List all species Experimental data
C-Cu 2 CuCN List all species Experimental data
C-F 95 SF5CF3 List all species Experimental data
C-Fe 2 Fe(CO)5 List all species Experimental data
C-Ge 1 GeH3CH3   Experimental data
C-I 2 CH3I List all species Experimental data
C-K 1 KCN   Experimental data
Cl-As 2 AsCl3 List all species Experimental data
Cl-Br 3 BrCl+ List all species Experimental data
Cl-Ca 2 CaCl2 List all species Experimental data
Cl-Cl 4 Cl3- List all species Experimental data
Cl-Cu 1 CuCl   Experimental data
Cl-Ga 3 GaCl3 List all species Experimental data
Cl-Ge 3 GeCl4 List all species Experimental data
Cl-I 1 ICl   Experimental data
Cl-K 1 KCl   Experimental data
Cl-Se 2 SeOCl2 List all species Experimental data
Cl-Ti 1 TiCl   Experimental data
Cl-Zn 2 ZnCl2 List all species Experimental data
C-N 134 NHCHNH2 List all species Experimental data
C-Na 1 NaCN   Experimental data
C-O 194 NH3COOH+ List all species Experimental data
C-P 4 P(CH3)3 List all species Experimental data
C-S 63 SF5CF3 List all species Experimental data
C-Se 3 CSe List all species Experimental data
C-Si 6 SiH3CCl3 List all species Experimental data
Cu-Cu 1 Cu2   Experimental data
C-Zn 4 ZnCN List all species Experimental data
D-C 5 CHD3 List all species Experimental data
D-Cl 1 DCl   Experimental data
D-D 1 D2   Experimental data
D-F 1 DF   Experimental data
D-N 2 ND3 List all species Experimental data
D-O 4 HDO List all species Experimental data
D-S 2 DS List all species Experimental data
F=Al 2 AlF+ List all species Experimental data
F-Al 4 AlFCl2 List all species Experimental data
F-As 3 AsF5 List all species Experimental data
F-Br 5 BrF5 List all species Experimental data
F-Ca 2 CaF2 List all species Experimental data
F-Cl 9 FClO List all species Experimental data
F-Cu 2 CuF2 List all species Experimental data
F-F 4 F3- List all species Experimental data
F-Ga 3 GaF3 List all species Experimental data
F-Ge 4 GeF4 List all species Experimental data
F-I 1 IF   Experimental data
F-K 1 KF   Experimental data
F-Kr 1 KrF2   Experimental data
F-Mg 4 MgF2 List all species Experimental data
F-Na 3 NaF+ List all species Experimental data
F-P 7 PF6- List all species Experimental data
F-S 18 SOF4 List all species Experimental data
F-Sc 2 ScF3 List all species Experimental data
F-Se 2 SeF6 List all species Experimental data
F-Si 9 SiH3F List all species Experimental data
F-Ti 1 TiF4   Experimental data
F-Zn 4 ZnF2 List all species Experimental data
Ga#As 1 GaAs   Experimental data
Ga=P 1 GaP   Experimental data
Ga-Ga 2 Ga2H6 List all species Experimental data
Ge-Ge 1 Ge2   Experimental data
H.F 1 H2F2   Experimental data
H.N 3 NH3NH3 List all species Experimental data
H.O 10 HCOOHH2O List all species Experimental data
H-Al 11 AlH4- List all species Experimental data
H-Ar 2 H2Ar List all species Experimental data
H-As 6 AsH3+ List all species Experimental data
H-B 25 LiBH4 List all species Experimental data
H-Be 5 BeH2+ List all species Experimental data
H-Br 4 HBr+ List all species Experimental data
H-C 793 ZnCH3 List all species Experimental data
H-Ca 3 CaH2 List all species Experimental data
H-Cl 4 HCl+ List all species Experimental data
H-Cr 1 CrH+   Experimental data
H-Cu 1 CuH   Experimental data
H-D 1 HD   Experimental data
He-He 1 He2+   Experimental data
H-F 7 HF+ List all species Experimental data
H-Ga 4 GaH3 List all species Experimental data
H-Ge 8 GeH4 List all species Experimental data
H-H 5 H3+ List all species Experimental data
H-He 2 HeH+ List all species Experimental data
H-I 1 HI   Experimental data
H-K 2 KH+ List all species Experimental data
H-Li 4 LiH+ List all species Experimental data
H-Mg 4 MgH2 List all species Experimental data
H-N 148 NNH+ List all species Experimental data
H-Na 3 NaH+ List all species Experimental data
H-Ne 2 NeH+ List all species Experimental data
H-O 152 SO2H+ List all species Experimental data
H-P 18 PH4+ List all species Experimental data
H-S 30 HSSSH List all species Experimental data
H-Sc 3 ScH3 List all species Experimental data
HSe 1 HSe   Experimental data
H-Se 6 HSe+ List all species Experimental data
H-Si 22 SiHCl3 List all species Experimental data
H-Ti 1 TiH   Experimental data
H-Zn 2 ZnH2 List all species Experimental data
I-I 2 I2+ List all species Experimental data
K-Br 1 KBr   Experimental data
K-K 1 K2   Experimental data
Li_F 1 LiF+   Experimental data
Li=O 1 LiO-   Experimental data
Li-B 2 LiBH4 List all species Experimental data
Li-Be 1 LiBe   Experimental data
Li-Br 3 LiBr+ List all species Experimental data
Li-C 3 LiCN List all species Experimental data
Li-Cl 3 LiCl+ List all species Experimental data
LI-F 2 LiF- List all species Experimental data
Li-K 1 LiK   Experimental data
Li-Li 5 Li3+ List all species Experimental data
Li-Mg 1 LiMg   Experimental data
Li-N 3 LiN+ List all species Experimental data
Li-Na 3 NaLi+ List all species Experimental data
Li-O 6 LiOH List all species Experimental data
Li-S 3 LiS+ List all species Experimental data
Mg=S 2 MgS+ List all species Experimental data
Mg-Cl 4 MgCl2 List all species Experimental data
Mg-Mg 3 Mg2+ List all species Experimental data
Mg-S 1 MgS   Experimental data
N#Al 1 AlN   Experimental data
N#As 1 AsN   Experimental data
N#N 4 NNOH+ List all species Experimental data
N#O 1 NO+   Experimental data
N#P 3 PN+ List all species Experimental data
N#S 1 NS+   Experimental data
N#Si 1 SiN-   Experimental data
N:N 2 C4H4N2 List all species Experimental data
N=Al 2 AlN+ List all species Experimental data
N=Cl 3 NCl+ List all species Experimental data
N=F 2 NF+ List all species Experimental data
N=Ga 1 GaN   Experimental data
N=N 30 NNS List all species Experimental data
N=O 48 ONONO List all species Experimental data
N=S 5 NS- List all species Experimental data
N=Se 1 NSe   Experimental data
N=Si 1 SiN+   Experimental data
N=Ti 1 TiN   Experimental data
Na-Al 1 NaAl   Experimental data
Na-Br 3 NaBr+ List all species Experimental data
Na-Cl 4 NaCl+ List all species Experimental data
Na-K 2 NaK+ List all species Experimental data
Na-Mg 1 NaMg   Experimental data
Na-Na 3 Na2+ List all species Experimental data
Na-S 1 NaS   Experimental data
N-Br 3 NBr3 List all species Experimental data
N-Cl 3 NH2Cl List all species Experimental data
Ne-Ne 2 Ne2+ List all species Experimental data
N-F 13 NH2F List all species Experimental data
N-K 1 KCN   Experimental data
N-N 19 ONNO List all species Experimental data
N-Na 1 NaCN   Experimental data
N-O 35 ONONO List all species Experimental data
N-Si 1 SiN   Experimental data
O#P 1 PO+   Experimental data
O=Al 1 AlO-   Experimental data
O=As 1 AsO   Experimental data
O=Cl 9 HOClO List all species Experimental data
O=Cu 1 CuO   Experimental data
O=F 1 FO+   Experimental data
O=Ga 1 GaO   Experimental data
O=Ge 3 GeO2 List all species Experimental data
O=Mg 2 MgO+ List all species Experimental data
O=O 7 O3H+ List all species Experimental data
O=P 11 PPO List all species Experimental data
O=S 28 SSO List all species Experimental data
O=Sc 1 ScO   Experimental data
O=Se 6 SeOCl2 List all species Experimental data
O=Si 3 SiO2 List all species Experimental data
O=Ti 1 TiO   Experimental data
O=V 1 VO   Experimental data
O-Al 2 AlO+ List all species Experimental data
O-As 1 AsO2   Experimental data
O-Br 9 OBrO List all species Experimental data
O-C 1 H2NCOHNH2+   Experimental data
O-Ca 3 CaOH List all species Experimental data
O-Cl 23 OClO+ List all species Experimental data
O-F 11 HSO3F List all species Experimental data
O-K 2 KO+ List all species Experimental data
O-Mg 5 MgSO4 List all species Experimental data
O-Na 7 NaOH List all species Experimental data
O-O 29 O3H+ List all species Experimental data
O-P 4 PO4--- List all species Experimental data
O-S 9 SO4-- List all species Experimental data
O-Se 3 SeO2 List all species Experimental data
O-Si 1 SiO   Experimental data
O-Ti 1 TiO2   Experimental data
O-Zn 1 ZnO   Experimental data
P#As 1 AsP   Experimental data
P#P 3 P2+ List all species Experimental data
P#S 1 PS+   Experimental data
P=P 1 PPO   Experimental data
P=S 2 PS- List all species Experimental data
P=Se 1 PSe   Experimental data
P-Br 1 PBr3   Experimental data
P-Cl 6 PCl5 List all species Experimental data
P-F 2 PF+ List all species Experimental data
P-P 2 P4 List all species Experimental data
S=As 1 AsS   Experimental data
S=Ge 2 GeS2 List all species Experimental data
S=O 1 SO2+   Experimental data
S=S 5 SSO List all species Experimental data
S=Se 3 SeS+ List all species Experimental data
S-Cl 9 SOCl2 List all species Experimental data
Se=Se 3 Se2+ List all species Experimental data
Si#P 1 SiP-   Experimental data
Si#Si 1 Si2   Experimental data
Si=P 2 SiP+ List all species Experimental data
Si=S 4 SiS2 List all species Experimental data
Si=Si 2 Si2+ List all species Experimental data
Si-Br 2 SiH3Br List all species Experimental data
Si-Cl 11 SiHCl3 List all species Experimental data
Si-Si 1 Si2H6   Experimental data
S-S 13 S8 List all species Experimental data
S-Zn 1 ZnS   Experimental data
Ti-Cl 1 TiCl4   Experimental data