Geometry & MOs

Info

ID:	354259
PubChem CID:	127286223
Reduced:	OF2N3C15H19 (1)
Stoich.:	AB2C3D15E19 (1)
Weight, g/mol:	378.205576
ΔH_f, kcal/mol:	-116.22
Dipole, Da:	3.14
IP(EA), eV:	-9.01(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations