Geometry & MOs

Info

ID:	273108
PubChem CID:	103770506
Reduced:	NF3O3C12H14 (1)
Stoich.:	AB3C3D12E14 (1)
Weight, g/mol:	282.081599
ΔH_f, kcal/mol:	-259.19
Dipole, Da:	5.38
IP(EA), eV:	-9.5(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C(=O)NCC(C(F)F)O)OC1=CC=CC=C1F

DOS

IR

Vibrations