Geometry & MOs

Info

ID:	32461
PubChem CID:	7837024
Reduced:	OS2N4C19H20 (1)
Stoich.:	AB2C4D19E20 (1)
Weight, g/mol:	365.065654
ΔH_f, kcal/mol:	56.02
Dipole, Da:	6.6
IP(EA), eV:	-8.79(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(cyanomethyl)-N-phenyl-2-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]acetamide

Drug info:

PubChemData

Smile

C1CCC(C1)N2C(=CC=N2)NC(=O)CSC3=NC(=CS3)C4=CC=CC=C4

DOS

IR

Vibrations