Geometry & MOs

Info

ID:	197441
PubChem CID:	78965660
Reduced:	OSN3H9C12 (1)
Stoich.:	ABC3D9E12 (1)
Weight, g/mol:	305.012267
ΔH_f, kcal/mol:	48.07
Dipole, Da:	6.78
IP(EA), eV:	-9.01(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-amino-4-cyanophenyl)-3,4-dichlorobenzamide

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1C#N)N)NC(=O)C2=CSC=C2

DOS

IR

Vibrations