Geometry & MOs

Info

ID:	250203
PubChem CID:	103094864
Reduced:	ClON3C16H18 (1)
Stoich.:	ABC3D16E18 (1)
Weight, g/mol:	306.051968
ΔH_f, kcal/mol:	-8.67
Dipole, Da:	3.1
IP(EA), eV:	-8.35(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-chloropyridin-2-yl)-3-(methylamino)-4-nitrobenzamide

Drug info:

PubChemData

Smile

CCCNC1=C(C=C(C=C1)C)C(=O)NC2=C(C=CC=N2)Cl

DOS

IR

Vibrations