Geometry & MOs

Info

ID:	393194
PubChem CID:	135019691
Reduced:	O3C8H10 (1)
Stoich.:	A3B8C10 (1)
Weight, g/mol:	308.217157
ΔH_f, kcal/mol:	-111.69
Dipole, Da:	1.76
IP(EA), eV:	-9.15(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,5R,6R)-5-[tert-butyl(dimethyl)silyl]oxy-1-methylspiro[5.5]undec-2-en-11-one

Drug info:

PubChemData

Smile

CC1=C(CC=CO1)C(=O)OC

DOS

IR

Vibrations