Geometry & MOs

Info

ID:	351923
PubChem CID:	127282841
Reduced:	FO2N4C21H31 (1)
Stoich.:	AB2C4D21E31 (1)
Weight, g/mol:	398.268176
ΔH_f, kcal/mol:	-139.04
Dipole, Da:	2.82
IP(EA), eV:	-9.0(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[1-(cyclopentylamino)-1-oxopropan-2-yl]-N-[(1-phenylcyclopropyl)methyl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1CCCC1)N2CCN(CC2)C(=O)NCCC3=CC(=CC=C3)F

DOS

IR

Vibrations