Geometry & MOs

Info

ID:	367670
PubChem CID:	127325213
Reduced:	O2N3C13H21 (1)
Stoich.:	A2B3C13D21 (1)
Weight, g/mol:	262.179361
ΔH_f, kcal/mol:	-69.28
Dipole, Da:	0.72
IP(EA), eV:	-8.89(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl-(4,5-dimethyl-1H-pyrazol-3-yl)methanone

Drug info:

PubChemData

Smile

C1CCN2CCN(CC2C1)C(=O)C(=O)NC3CC3

DOS

IR

Vibrations