Geometry & MOs

Info

ID:	433241
PubChem CID:	135173378
Reduced:	SO2N5C30H31 (1)
Stoich.:	AB2C5D30E31 (1)
Weight, g/mol:	585.240976
ΔH_f, kcal/mol:	19.83
Dipole, Da:	4.36
IP(EA), eV:	-8.25(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-[3-[[3-(dimethylamino)phenyl]carbamoylamino]-2-methoxyanilino]sulfanyl-4-methoxyphenyl]-N,N-dimethylbenzamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations