Geometry & MOs

Info

ID:	433289
PubChem CID:	135173426
Reduced:	SN3O4C24H27 (1)
Stoich.:	AB3C4D24E27 (1)
Weight, g/mol:	569.246061
ΔH_f, kcal/mol:	-87.3
Dipole, Da:	7.39
IP(EA), eV:	-7.94(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-[3-[[[3-(dimethylamino)phenyl]-methylcarbamoyl]amino]anilino]sulfanyl-4-methoxyphenyl]-N,N-dimethylbenzamide

Drug info:

PubChemData

Smile

CN(C)C1=CC=CC(=C1)NS(=O)(=O)C2=C(C=CC(=C2)C3=CC(=CC=C3)C(=O)N(C)C)OC

DOS

IR

Vibrations