Geometry & MOs

Info

ID:	35241
PubChem CID:	7979560
Reduced:	SN2O4C22H28 (1)
Stoich.:	AB2C4D22E28 (1)
Weight, g/mol:	389.114234
ΔH_f, kcal/mol:	-164.18
Dipole, Da:	4.41
IP(EA), eV:	-8.89(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-[3-[2-(4-ethoxybenzoyl)hydrazinyl]-3-oxopropyl]benzamide

Drug info:

PubChemData

Smile

C[C@H]1CCC[C@@H](N1C(=O)COC(=O)[C@@H]2CS[C@@]3(N2C(=O)CC3)C4=CC=CC=C4)C

DOS

IR

Vibrations