Geometry & MOs

Info

ID:	368504
PubChem CID:	127329316
Reduced:	ON3C16H23 (1)
Stoich.:	AB3C16D23 (1)
Weight, g/mol:	267.194677
ΔH_f, kcal/mol:	-27.98
Dipole, Da:	4.89
IP(EA), eV:	-8.76(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1CN2CCCCC2CN1C(=O)C3=CC=CC(=N3)C

DOS

IR

Vibrations