Geometry & MOs

Info

ID:	380211
PubChem CID:	134970573
Reduced:	O4H18C19 (1)
Stoich.:	A4B18C19 (1)
Weight, g/mol:	218.13068
ΔH_f, kcal/mol:	-97.0
Dipole, Da:	0.92
IP(EA), eV:	-9.47(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-6,6-dimethyl-2-phenyl-4,8-dioxaspiro[2.5]octane

Drug info:

PubChemData

Smile

COC(=O)C1([C@@H](C1C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC

DOS

IR

Vibrations