Geometry & MOs

Info

ID:	353207
PubChem CID:	127284387
Reduced:	O3N5C17H21 (1)
Stoich.:	A3B5C17D21 (1)
Weight, g/mol:	380.148455
ΔH_f, kcal/mol:	-74.85
Dipole, Da:	2.56
IP(EA), eV:	-9.4(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[4-(6-oxo-1H-pyridine-3-carbonyl)piperazine-1-carbonyl]-3,4-dihydro-1H-quinolin-2-one

Drug info:

PubChemData

Smile

CC1=CC(=NN1CC(=O)N2CCN(CC2)C(=O)C3=CNC(=O)C=C3)C

DOS

IR

Vibrations