Geometry & MOs

Info

ID:	422933
PubChem CID:	135118645
Reduced:	SO2N7C21H25 (1)
Stoich.:	AB2C7D21E25 (1)
Weight, g/mol:	340.178693
ΔH_f, kcal/mol:	48.99
Dipole, Da:	6.71
IP(EA), eV:	-9.52(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(4R,5S)-4-hydroxy-7-azaspiro[4.5]decane-7-carbonyl]-6-methyl-1H-quinolin-2-one

Drug info:

PubChemData

Smile

CC1=C(SC=N1)CN2CC3(CCN(CC3)C4=NN=NN4C5=CC=CC=C5)OCCC2=O

DOS

IR

Vibrations