Geometry & MOs

Info

ID:	4740
PubChem CID:	11953
Reduced:	NOH5C8 (1)
Stoich.:	ABC5D8 (1)
Weight, g/mol:	131.037114
ΔH_f, kcal/mol:	31.8
Dipole, Da:	4.64
IP(EA), eV:	-10.44(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzoyl cyanide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)C#N

DOS

IR

Vibrations