Geometry & MOs

Info

ID:	420650
PubChem CID:	135114583
Reduced:	OF3N5C21H22 (1)
Stoich.:	AB3C5D21E22 (1)
Weight, g/mol:	344.153621
ΔH_f, kcal/mol:	-118.29
Dipole, Da:	5.92
IP(EA), eV:	-8.93(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-fluoro-2-[(4R,5R)-4-hydroxy-7-azaspiro[4.5]decane-7-carbonyl]-1H-quinolin-4-one

Drug info:

PubChemData

Smile

CN(C)C1=NC(=CC(=N1)N2C[C@H]([C@@H](C2)O)CC3=CC=NC4=CC=CC=C34)C(F)(F)F

DOS

IR

Vibrations