Geometry & MOs

Info

ID:	152562
PubChem CID:	56311518
Reduced:	N3O3C21H25 (1)
Stoich.:	A3B3C21D25 (1)
Weight, g/mol:	428.161518
ΔH_f, kcal/mol:	-16.25
Dipole, Da:	7.99
IP(EA), eV:	-9.01(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N'-[2-[4-[2-(2-methylphenyl)acetyl]piperazin-1-yl]acetyl]benzohydrazide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CC(=O)N2CCN(CC2)C(C)C3=CC(=CC=C3)[N+](=O)[O-]

DOS

IR

Vibrations