Geometry & MOs

Info

ID:	68240
PubChem CID:	46508032
Reduced:	N2F4O5H16C20 (1)
Stoich.:	A2B4C5D16E20 (1)
Weight, g/mol:	391.117963
ΔH_f, kcal/mol:	-385.05
Dipole, Da:	6.11
IP(EA), eV:	-9.32(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-ethoxycarbonyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl)methyl 7-fluoro-2-oxo-3,4-dihydro-1H-quinoline-4-carboxylate

Drug info:

PubChemData

Smile

CC(C(=O)NC1=CC=C(C=C1)OC(F)(F)F)OC(=O)C2CC(=O)NC3=C2C=CC(=C3)F

DOS

IR

Vibrations