Geometry & MOs

Info

ID:	11560
PubChem CID:	117604
Reduced:	O2C11H14 (1)
Stoich.:	A2B11C14 (1)
Weight, g/mol:	178.09938
ΔH_f, kcal/mol:	-76.88
Dipole, Da:	1.57
IP(EA), eV:	-9.59(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,4R)-2,4-dimethyl-2-phenyl-1,3-dioxolane

Drug info:

PubChemData

Smile

C[C@@H]1CO[C@](O1)(C)C2=CC=CC=C2

DOS

IR

Vibrations