Geometry & MOs

Info

ID:	368609
PubChem CID:	127329642
Reduced:	ON5C23H33 (1)
Stoich.:	AB5C23D33 (1)
Weight, g/mol:	398.268176
ΔH_f, kcal/mol:	-4.22
Dipole, Da:	3.78
IP(EA), eV:	-8.6(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-N-[[2-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]acetamide

Drug info:

PubChemData

Smile

CC1CN2CCCCC2CN1CC(=O)NCC3=C(N(N=C3C)C4=CC=CC=C4)C

DOS

IR

Vibrations