Geometry & MOs

Info

ID:	21083
PubChem CID:	587122
Reduced:	ClO2N3H16C20 (1)
Stoich.:	AB2C3D16E20 (1)
Weight, g/mol:	365.093104
ΔH_f, kcal/mol:	-11.91
Dipole, Da:	2.2
IP(EA), eV:	-9.19(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-chlorobenzoyl)amino]-N-(pyridin-3-ylmethyl)benzamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C(=O)NCC2=CN=CC=C2)NC(=O)C3=CC=C(C=C3)Cl

DOS

IR

Vibrations