Geometry & MOs

Info

ID:	174154
PubChem CID:	75731576
Reduced:	N2O3C25H34 (1)
Stoich.:	A2B3C25D34 (1)
Weight, g/mol:	492.208279
ΔH_f, kcal/mol:	-127.05
Dipole, Da:	3.82
IP(EA), eV:	-9.08(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[(4-methylphenyl)sulfonylmethylamino]-1-oxo-3-phenylbutan-2-yl]-N-propylbenzamide

Drug info:

PubChemData

Smile

CCCCNC(=O)C(C1=CC(=CC=C1)O)N(CCC)C(=O)CC(C)C2=CC=CC=C2

DOS

IR

Vibrations