Geometry & MOs

Info

ID:	27484
PubChem CID:	821578
Reduced:	ClNO3H10C11 (1)
Stoich.:	ABC3D10E11 (1)
Weight, g/mol:	282.055991
ΔH_f, kcal/mol:	-105.0
Dipole, Da:	8.35
IP(EA), eV:	-9.91(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-chlorophenyl)-1-cyanoethenyl]benzamide

Drug info:

PubChemData

Smile

CC(=O)NC(=CC1=CC=CC=C1Cl)C(=O)O

DOS

IR

Vibrations