Geometry & MOs

Info

ID:	380433
PubChem CID:	134970880
Reduced:	O6C19H24 (1)
Stoich.:	A6B19C24 (1)
Weight, g/mol:	322.196421
ΔH_f, kcal/mol:	-227.62
Dipole, Da:	4.01
IP(EA), eV:	-9.96(-1.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5S,9R)-9-[tert-butyl(dimethyl)silyl]oxy-3-prop-2-enoxyspiro[4.4]non-3-en-2-one

Drug info:

PubChemData

Smile

CCO[C@@H]1C2CCC([C@]3([C@@H]2C(O1)C4=C(C3)C(=O)C(=CC4=O)OC)C)O

DOS

IR

Vibrations