Geometry & MOs

Info

ID:	309985
PubChem CID:	126572202
Reduced:	FN2O5C37H49 (1)
Stoich.:	AB2C5D37E49 (1)
Weight, g/mol:	302.082205
ΔH_f, kcal/mol:	-253.16
Dipole, Da:	5.33
IP(EA), eV:	-8.59(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-chloro-6-(1,5-dimethyl-6-oxopyridin-3-yl)-3,4-dihydro-1H-quinolin-2-one

Drug info:

PubChemData

Smile

CC1=C(C(=C(C(=N1)CO)C2=CC=C(C=C2)OCCC3=CC=C(C=C3)F)N4CCC(CC4)(C)C)C(C(=O)OC(C)C)OC(C)(C)C

DOS

IR

Vibrations