Geometry & MOs

Info

ID:	273090
PubChem CID:	103770477
Reduced:	F2O2N3C13H15 (1)
Stoich.:	A2B2C3D13E15 (1)
Weight, g/mol:	282.081599
ΔH_f, kcal/mol:	-156.4
Dipole, Da:	4.32
IP(EA), eV:	-9.24(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,3-difluoro-2-hydroxypropyl)-4-oxo-1H-quinoline-2-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)NC(=N2)CCC(=O)NCC(C(F)F)O

DOS

IR

Vibrations