Geometry & MOs

Info

ID:	359610
PubChem CID:	127298884
Reduced:	O3N4C22H22 (1)
Stoich.:	A3B4C22D22 (1)
Weight, g/mol:	283.077535
ΔH_f, kcal/mol:	-17.22
Dipole, Da:	5.61
IP(EA), eV:	-9.04(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-chloro-8-fluoro-3,4-dihydro-2H-quinolin-1-yl)-(oxolan-3-yl)methanone

Drug info:

PubChemData

Smile

CC1=C(N=NN1C2=CC3=C(C=C2)OCCO3)C(=O)N4CCCC5=CC=CC=C5C4

DOS

IR

Vibrations