Geometry & MOs

Info

ID:	420001
PubChem CID:	135110683
Reduced:	N3C19H23 (1)
Stoich.:	A3B19C23 (1)
Weight, g/mol:	364.145678
ΔH_f, kcal/mol:	45.76
Dipole, Da:	1.34
IP(EA), eV:	-8.84(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[[(4R,5R)-4-hydroxy-7-azaspiro[4.5]decan-7-yl]sulfonyl]-3,4-dihydro-1H-quinolin-2-one

Drug info:

PubChemData

Smile

CC1=NC=C2CCC3(C2=N1)CCCN(C3)CC4=CC=CC=C4

DOS

IR

Vibrations