Geometry & MOs

Info

ID:	62548
PubChem CID:	26719858
Reduced:	ClSN2O3C18H19 (1)
Stoich.:	ABC2D3E18F19 (1)
Weight, g/mol:	380.077514
ΔH_f, kcal/mol:	-102.41
Dipole, Da:	4.97
IP(EA), eV:	-8.85(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-chloro-4-methylphenyl)-3,4,5-trimethoxy-2-nitrobenzamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=O)CCNC(=O)CCC(=O)C2=CC=CS2)Cl

DOS

IR

Vibrations