Geometry & MOs

Info

ID:	433291
PubChem CID:	135173428
Reduced:	SN5O5C32H35 (1)
Stoich.:	AB5C5D32E35 (1)
Weight, g/mol:	421.182398
ΔH_f, kcal/mol:	-96.61
Dipole, Da:	7.41
IP(EA), eV:	-8.02(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN(C)C1=CC(=CC=C1)N(C)C(=O)NC2=CC(=CC=C2)NS(=O)(=O)C3=C(C=CC(=C3)C4=CC(=CC=C4)C(=O)N(C)C)OC

DOS

IR

Vibrations