Geometry & MOs

Info

ID:	19545
PubChem CID:	567251
Reduced:	ClO2N4C15H21 (1)
Stoich.:	AB2C4D15E21 (1)
Weight, g/mol:	324.135304
ΔH_f, kcal/mol:	-70.26
Dipole, Da:	4.55
IP(EA), eV:	-9.02(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(3-chloro-2-methylphenyl)-N-(2-piperazin-1-ylethyl)oxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1Cl)NC(=O)C(=O)NCCN2CCNCC2

DOS

IR

Vibrations