Geometry & MOs

Info

ID:	391973
PubChem CID:	135011516
Reduced:	SN2O2C22H30 (1)
Stoich.:	AB2C2D22E30 (1)
Weight, g/mol:	356.155849
ΔH_f, kcal/mol:	-55.85
Dipole, Da:	4.57
IP(EA), eV:	-9.39(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(hex-5-enylamino)-(4-methylphenyl)-oxo-lambda6-sulfanylidene]benzamide

Drug info:

PubChemData

Smile

CCCCN(CCCC)S(=NC(=O)C1=CC=CC=C1)(=O)C2=CC=C(C=C2)C

DOS

IR

Vibrations