Geometry & MOs

Info

ID:	422496
PubChem CID:	135117929
Reduced:	O2N6C19H22 (1)
Stoich.:	A2B6C19D22 (1)
Weight, g/mol:	346.144806
ΔH_f, kcal/mol:	17.0
Dipole, Da:	10.28
IP(EA), eV:	-8.33(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-chloro-2-[[(4R,5S)-4-hydroxy-7-azaspiro[4.5]decan-7-yl]methyl]-1H-quinolin-4-one

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)C3(CCN(CC3)C4=CC5=NN=CN5C(=N4)N)OCC2

DOS

IR

Vibrations