Geometry & MOs

Info

ID:	354176
PubChem CID:	127286118
Reduced:	OF2N3C15H19 (1)
Stoich.:	AB2C3D15E19 (1)
Weight, g/mol:	263.17461
ΔH_f, kcal/mol:	-117.75
Dipole, Da:	6.31
IP(EA), eV:	-9.02(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-methylpyrazol-4-yl)-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carboxamide

Drug info:

PubChemData

Smile

C1CCN2CCN(CC2C1)C(=O)NC3=CC(=C(C=C3)F)F

DOS

IR

Vibrations