Geometry & MOs

Info

ID:	368506
PubChem CID:	127329318
Reduced:	O2N3C16H23 (1)
Stoich.:	A2B3C16D23 (1)
Weight, g/mol:	375.198048
ΔH_f, kcal/mol:	-87.71
Dipole, Da:	6.24
IP(EA), eV:	-8.44(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1CN2CCCCC2CN1C(=O)C3=CC=C(NC3=O)C

DOS

IR

Vibrations