Geometry & MOs

Info

ID:	368502
PubChem CID:	127329314
Reduced:	SO2N3C18H27 (1)
Stoich.:	AB2C3D18E27 (1)
Weight, g/mol:	377.210327
ΔH_f, kcal/mol:	-83.83
Dipole, Da:	4.92
IP(EA), eV:	-8.75(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carbonyl)phenyl]benzamide

Drug info:

PubChemData

Smile

CC1CN2CCCCC2CN1C(=O)CC(C3=CC=CS3)NC(=O)C

DOS

IR

Vibrations