Geometry & MOs

Info

ID:	399206
PubChem CID:	135038725
Reduced:	O3C14H22 (1)
Stoich.:	A3B14C22 (1)
Weight, g/mol:	258.146724
ΔH_f, kcal/mol:	-165.84
Dipole, Da:	2.77
IP(EA), eV:	-9.91(0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3'aR,4R,7'S,7'aS)-2,2,2',2',7'-pentamethylspiro[1,3-dioxolane-4,6'-3a,4,7,7a-tetrahydro-[1,3]dioxolo[4,5-c]pyran]

Drug info:

PubChemData

Smile

C[C@H]1[C@H](C[C@]2([C@@]1(CC(=O)[C@H]2C)C)C)C(=O)OC

DOS

IR

Vibrations