Geometry & MOs

Info

ID:	139002
PubChem CID:	52456605
Reduced:	N3O3C22H29 (1)
Stoich.:	A3B3C22D29 (1)
Weight, g/mol:	303.092915
ΔH_f, kcal/mol:	-76.3
Dipole, Da:	5.0
IP(EA), eV:	-8.78(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-dimethyl-N-(2-methylphenyl)sulfonylbenzamide

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)CN(C)[C@@H](C)C(=O)N2CCN(CC2)C(=O)C3=CC=CO3

DOS

IR

Vibrations