Geometry & MOs

Info

ID:	41524
PubChem CID:	8146124
Reduced:	S2O3N4C18H24 (1)
Stoich.:	A2B3C4D18E24 (1)
Weight, g/mol:	323.163377
ΔH_f, kcal/mol:	-51.59
Dipole, Da:	4.45
IP(EA), eV:	-8.23(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3Z)-N-(2-phenylphenyl)-3-(propanoylhydrazinylidene)butanamide

Drug info:

PubChemData

Smile

CCOC(=O)[C@@H]1CCCN(C1)CN2C(=S)SC(=N2)NC3=CC=C(C=C3)OC

DOS

IR

Vibrations