Geometry & MOs

Info

ID:	354229
PubChem CID:	127286193
Reduced:	FON2C10H12 (2)
Stoich.:	ABC2D10E12 (2)
Weight, g/mol:	376.171082
ΔH_f, kcal/mol:	-147.63
Dipole, Da:	8.84
IP(EA), eV:	-8.58(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[8-(difluoromethoxy)quinolin-5-yl]-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carboxamide

Drug info:

PubChemData

Smile

C1CCN(C1)CC2CCCN2C(=O)NC3=C4C=CC=NC4=C(C=C3)OC(F)F

DOS

IR

Vibrations