Geometry & MOs

Info

ID:	370379
PubChem CID:	127338402
Reduced:	N3O3C21H23 (1)
Stoich.:	A3B3C21D23 (1)
Weight, g/mol:	329.153955
ΔH_f, kcal/mol:	-110.56
Dipole, Da:	10.2
IP(EA), eV:	-8.54(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carbonyl)-6-fluoro-1H-quinolin-2-one

Drug info:

PubChemData

Smile

C1CCC2=C(CC1)NC(=O)C(=C2)C(=O)NC3CC(=O)N(C3)C4=CC=CC=C4

DOS

IR

Vibrations