Geometry & MOs

Info

ID:	433294
PubChem CID:	135173431
Reduced:	SO3N5C30H31 (1)
Stoich.:	AB3C5D30E31 (1)
Weight, g/mol:	538.203862
ΔH_f, kcal/mol:	-23.26
Dipole, Da:	6.72
IP(EA), eV:	-8.35(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-methoxy-3-[3-(2-oxo-3-phenylimidazolidin-1-yl)anilino]sulfanylphenyl]-N,N-dimethylbenzamide

Drug info:

PubChemData

Smile

CN(C)C1=CC=CC(=C1)NC(=O)NC2=CC(=CC=C2)NSC3=C(C=CC(=C3)C(=O)NCC4=CC=CC=C4)OC

DOS

IR

Vibrations