Geometry & MOs

Info

ID:	391974
PubChem CID:	135011519
Reduced:	SN2O2C20H24 (1)
Stoich.:	AB2C2D20E24 (1)
Weight, g/mol:	356.155849
ΔH_f, kcal/mol:	-24.76
Dipole, Da:	6.75
IP(EA), eV:	-9.51(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[[(E)-hex-4-enyl]amino]-(4-methylphenyl)-oxo-lambda6-sulfanylidene]benzamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=NC(=O)C2=CC=CC=C2)(=O)NCCCCC=C

DOS

IR

Vibrations