Geometry & MOs

Info

ID:	368616
PubChem CID:	127329666
Reduced:	N3O3C20H29 (1)
Stoich.:	A3B3C20D29 (1)
Weight, g/mol:	358.236876
ΔH_f, kcal/mol:	-108.4
Dipole, Da:	1.92
IP(EA), eV:	-8.29(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1CN2CCCCC2CN1CC(=O)NC3=CC4=C(C=C3)OCCCO4

DOS

IR

Vibrations