Geometry & MOs

Info

ID:	26947
PubChem CID:	804654
Reduced:	NO2C9H9 (2)
Stoich.:	AB2C9D9 (2)
Weight, g/mol:	322.087291
ΔH_f, kcal/mol:	-137.27
Dipole, Da:	4.54
IP(EA), eV:	-9.18(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-3-chloro-N-pyridin-2-ylbenzamide

Drug info:

PubChemData

Smile

CCCC(=O)NC1=CC=CC(=C1)C(=O)NC2=CC=CC=C2C(=O)O

DOS

IR

Vibrations