Geometry & MOs

Info

ID:	354472
PubChem CID:	127287021
Reduced:	ON6C15H26 (1)
Stoich.:	AB6C15D26 (1)
Weight, g/mol:	385.247775
ΔH_f, kcal/mol:	-13.74
Dipole, Da:	2.46
IP(EA), eV:	-8.84(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carboxamide

Drug info:

PubChemData

Smile

CC(CN1C=NC=N1)NC(=O)N2CCCC2CN3CCCC3

DOS

IR

Vibrations