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Compare Calculated Bonds for N-C

17 01 10 14 40

CCSD/aug-cc-pVTZ

Histogram of Bond lengths (in Å) vs number of species


Values greater than 1.65 are in the 1.65 bin. Values less than 1.10 are in the 1.10 bin.

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1.10 1.15 1.20 1.25 1.30 1.35 1.40 1.45 1.50 1.55 1.60 1.65
bond lengths (Å)

Summary: (Å)
Average bond length Standard deviation
1.310 0.117

  Species Name Bond Length (Å)
Lowest value HNC+ hydrogen isocyanide cation 1.136
Highest value CH5N2O+ urea, N-protonated 1.552

Calculated Bond lengths
Click on entry for all calculated results.
Species Name Bond Length (Å) Atom1 index Atom2 index
CN- cyanide anion 1.177 1 2
CN Cyano radical 1.167 1 2
HCN Hydrogen cyanide 1.151 1 3
HCN+ hydrogen cyanide cation 1.212 1 3
HNC hydrogen isocyanide 1.168 1 2
HNC+ hydrogen isocyanide cation 1.136 1 2
H2CN Dihydrogen cyanide radical 1.247 1 2
CNH2 Aminomethylidyne radical 1.297 1 2
HCNH methyleneazane 1.235 1 2
CH2NH Methanimine 1.271 1 2
CH2NH+ Methanimine cation 1.234 1 2
CHNH2 aminomethylene 1.313 1 2
CH2NH2+ methyleneamine cation 1.275 1 2
CH3NH2 methyl amine 1.465 1 2
CH3NH2+ methyl amine cation 1.431 1 2
NCN Cyanoimidogen 1.230 1 2
    1.230 1 3
LiCN lithium cyanide 1.176 2 3
CNN Diazocarbene 1.228 1 2
CN2 3H-Diazirin-3-ylidene 1.386 1 2
    1.386 1 3
NaCN Sodium Cyanide 1.178 1 2
AlCN Aluminum monocyanide 1.164 2 3
AlNC Aluminum isocyanide 1.180 2 3
ZnCN Zinc monocyanide 1.162 2 3
ZnNC Zinc isocyanide 1.177 2 3
NCO isocyanato radical 1.227 1 2
FCN Cyanogen fluoride 1.155 1 3
CNF iso cyanogen fluoride 1.174 1 2
ClCN chlorocyanogen 1.154 2 3
BrCN Cyanogen bromide 1.157 1 2
HCCN cyanomethylene 1.189 2 3
HCNO fulminic acid 1.154 2 3
HSCN thiocyanic acid 1.158 2 3
HNCNH diiminomethane 1.224 1 2
    1.224 1 3
NH2CN cyanamide 1.159 1 2
    1.333 1 3
CH3CN Acetonitrile 1.154 2 3
CHNHCH 1H-Azirine 1.515 1 2
    1.515 1 3
CH3NC methyl isocyanide 1.424 1 2
    1.167 2 3
NCNH3+ Cyanamide, protonated 1.152 1 2
    1.410 1 3
HNCNH2+ diiminomethane, protonated 1.153 1 2
    1.287 1 3
NH3CN+ cyanamide, amine protonated 1.410 1 2
    1.152 1 3
H2CCNH Ethenimine 1.227 2 3
NH2CNH+ cyanamide, cn protonated 1.147 1 2
    1.290 1 3
H2CNCH methyleneaminomethylene 1.276 1 2
    1.223 2 3
CHONH2 formamide 1.357 1 3
CH2NOH formaldoxime 1.270 1 2
CH3NO nitrosomethane 1.481 1 2
CNOH3 1,2-oxaziridine 1.433 1 2
HOCHNH hydroxymethylimine 1.263 1 3
CHSNH2 thioformamide 1.340 1 3
NHCHSH Methanimidothioic acid 1.268 1 2
CH3CHN methylmethaniminyl radical 1.249 1 3
CH2CHNH vinylazine 1.312 1 3
H2CONH2+ protonated formamide 1.294 1 3
NH2CHOH+ Formamide, O-protonated 1.294 1 3
CH3CHNH ethanimine 1.271 2 3
NH2CH2OH aminomethanol 1.439 1 2
NH2CH2NH2 diaminomethane 1.459 1 2
    1.459 1 3
CH3CH2NH2 Ethylamine 1.466 1 2
CH3NHCH3 Dimethylamine 1.453 1 3
    1.453 1 4
(CH3)2NH2+ dimethylammonium cation 1.499 1 2
    1.499 1 3
CH3CH2NH3+ ethylamine, protonated 1.518 1 2
C2N2 Cyanogen 1.155 1 3
    1.155 2 4
HCCCN Cyanoacetylene 1.154 1 2
HNCCNH Ethenediimine 1.246 1 3
    1.246 2 4
H2CNCN cyanamide, methylene 1.158 3 4
    1.276 1 2
    1.357 2 3
C3H3N acrylonitrile 1.156 1 2
C3H3N+ acrylonitrile cation 1.175 1 2
CH3N3 methyl azide 1.473 1 2
CH3NO2 Methane, nitro- 1.488 1 2
HOCH2CN cyanomethanol 1.155 2 7
NH2COOH Carbamic acid 1.359 1 3
CH3NCO methylisocyante 1.445 1 2
    1.200 2 3
C2H3NO Nitrosoethylene 1.435 2 3
NH2CH2CN Aminoacetonitrile 1.155 3 4
    1.455 1 2
NH2CCNH2 Diaminoacetylene 1.362 1 3
    1.362 2 4
CH3NHN2+ methyl azide, protonated 1.489 1 2
NH2CONH2 Urea 1.383 1 3
    1.383 1 4
NH3COOH+ protonated Carbamic acid 1.519 1 3
NH2COOH2+ Carbamic acid, O-protonated 1.305 1 3
C2H5CN ethyl cyanide 1.155 3 4
CH3CONH2 Acetamide 1.368 2 3
CH3CHNOH Acetaldoxime 1.269 2 3
CH5N2O+ urea, N-protonated 1.552 1 3
    1.332 1 4
H2NCOHNH2+ urea, protonated 1.321 1 3
    1.314 1 4
H2NCHCHNH2 diaminoethylene 1.418 1 3
    1.418 2 4
CH3NNCH3 (Z)-1,2-Dimethyldiazene 1.477 1 3
    1.477 2 4
CH3NNCH3 (E)-1,2-Dimethyldiazene 1.464 1 3
    1.464 2 4
C3H7N Cyclopropylamine 1.439 1 3
CH3CH(NH2)CH3 2-Propanamine 1.466 1 2
N(CH3)3 Trimethylamine 1.449 1 2
    1.449 1 3
    1.449 1 4
NH2CH2CH2CH3 1-Propanamine 1.463 3 4
C2H2N2O Furazan 1.298 2 4
    1.298 3 5
C3H3N2- imidizolyl anion 1.346 1 2
    1.346 1 3
    1.370 2 4
    1.370 3 5
C3H3N2 imidazolyl radical 1.370 1 2
    1.370 1 3
    1.314 2 4
    1.314 3 5
C3H3NO Isoxazole 1.304 2 4
C3H3NS Thiazole 1.297 2 4
    1.379 4 5
C3H4N2 1H-Imidazole 1.307 2 4
    1.382 4 5
    1.361 1 2
    1.379 1 3
C3H4N2 4H-Imidazole 1.278 2 3
    1.458 3 4
    1.433 1 2
    1.284 1 5
C4H4N- pyrrolide anion 1.361 1 2
    1.361 1 3
C4H4N pyrrolide radical 1.342 1 2
    1.342 1 3
C4H5N Pyrrole 1.371 1 3
    1.371 1 4
C4H2N2 Fumaronitrile 1.156 3 5
    1.156 4 6
CH(CN)3 tricyanomethane 1.153 3 6
    1.153 4 7
    1.153 5 8