Geometry & MOs

Info

ID:	187187
PubChem CID:	77541572
Reduced:	F3N4O4H17C19 (1)
Stoich.:	A3B4C4D17E19 (1)
Weight, g/mol:	577.251891
ΔH_f, kcal/mol:	-230.36
Dipole, Da:	4.93
IP(EA), eV:	-9.15(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohexyl-3-[2-(2,4-difluorophenyl)ethoxy]-N-[2-[2-(8-hydroxy-2-oxo-4aH-quinolin-5-yl)ethylamino]ethyl]propanamide;hydrochloride

Drug info:

PubChemData

Smile

CC(=O)NC1=C(C=CC(=C1)N2C(=O)N(C(=O)C(N2)OC)CC3=C(C=C(C=C3)F)F)F

DOS

IR

Vibrations