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Compare Calculated Bonds for N-C

17 01 10 14 40

QCISD(T)/6-311+G(3df,2p)

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
1.285 0.114

  Species Name Bond Length (Å)
Lowest value HNC+ hydrogen isocyanide cation 1.142
Highest value CHNCH2 2H-Azirine 1.571

Calculated Bond lengths
Click on entry for all calculated results.
Species Name Bond Length (Å) Atom1 index Atom2 index
HCN Hydrogen cyanide 1.160 1 3
HCN+ hydrogen cyanide cation 1.220 1 3
HNC+ hydrogen isocyanide cation 1.142 1 2
CH2NH Methanimine 1.277 1 2
CH2NH+ Methanimine cation 1.237 1 2
CHNH2 aminomethylene 1.317 1 2
CH3NH2 methyl amine 1.468 1 2
CNN Diazocarbene 1.237 1 2
AlCN Aluminum monocyanide 1.171 2 3
AlNC Aluminum isocyanide 1.188 2 3
KCN Potassium cyanide 1.184 2 3
NCO isocyanato radical 1.233 1 2
CNF iso cyanogen fluoride 1.184 1 2
BrCN Cyanogen bromide 1.166 1 2
HCNO fulminic acid 1.165 2 3
HSCN thiocyanic acid 1.166 2 3
HNCS Isothiocyanic acid 1.210 1 2
HNCNH diiminomethane 1.229 1 2
    1.229 1 3
CH3CN- acetonitrile anion 1.164 2 3
CH3CN Acetonitrile 1.162 2 3
CHNCH2 2H-Azirine 1.263 1 2
    1.571 1 3
HCNCH2+ 2H-Azirine cation 1.215 1 2
    1.472 1 3
CHNHCH 1H-Azirine 1.522 1 2
    1.522 1 3
NH3CN+ cyanamide, amine protonated 1.414 1 2
    1.160 1 3
HCCNH2 Ethynamine 1.365 2 3
NH2CNH+ cyanamide, cn protonated 1.153 1 2
    1.292 1 3
HOCHNH hydroxymethylimine 1.266 1 3
CHSNH2 thioformamide 1.346 1 3
NHCHSH Methanimidothioic acid 1.276 1 2
NH2CHOH+ Formamide, O-protonated 1.299 1 3
HNCCNH Ethenediimine 1.253 1 3
    1.253 2 4
H2CNCN cyanamide, methylene 1.167 3 4
    1.284 1 2
    1.357 2 3
CH3NO2 Methane, nitro- 1.493 1 2
HOCH2CN cyanomethanol 1.162 2 7
C2H3NO Nitrosoethylene 1.434 2 3
C2H5CN ethyl cyanide 1.163 3 4
CH3C(OH)=NH Ethaninidic acid 1.274 1 3
H2NCHCHNH2 diaminoethylene 1.420 1 3
    1.420 2 4
NH2CH2CH2CH3 1-Propanamine 1.466 3 4
C2H2N2O Furazan 1.308 2 4
    1.308 3 5
C3H3NO Isoxazole 1.313 2 4
C3H3NS Thiazole 1.307 2 4
    1.379 4 5