Geometry & MOs

Info

ID:	368552
PubChem CID:	127329455
Reduced:	F2O2N3C15H15 (1)
Stoich.:	A2B2C3D15E15 (1)
Weight, g/mol:	287.126991
ΔH_f, kcal/mol:	-102.1
Dipole, Da:	7.48
IP(EA), eV:	-9.3(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,1-dimethyl-4-oxo-N-(oxolan-3-yl)cinnoline-3-carboxamide

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2C(=O)C(=N1)C(=O)N(CC(F)F)C3CC3

DOS

IR

Vibrations