Geometry & MOs

Info

ID:	404526
PubChem CID:	135066644
Reduced:	N2O2C17H20 (1)
Stoich.:	A2B2C17D20 (1)
Weight, g/mol:	513.236906
ΔH_f, kcal/mol:	-46.1
Dipole, Da:	4.78
IP(EA), eV:	-8.82(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5S,8S,9S)-8-[tert-butyl(dimethyl)silyl]oxy-6-(4-methylphenyl)sulfonyl-9-phenyl-6-azaspiro[4.5]decan-4-one

Drug info:

PubChemData

Smile

CC(C)(C1=CC=CC=N1)NC(=O)CC2=CC=CC=C2OC

DOS

IR

Vibrations