Geometry & MOs

Info

ID:

380264

PubChem CID:

134970653

Reduced:

LiO2C12H13 (1)

Stoich.:

AB2C12D13 (1)

Weight, g/mol:

190.09938

ΔHf, kcal/mol:

-55.22

Dipole, Da:

5.9

IP(EA), eV:

-7.65(-0.49)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-methyl-1-(3-phenyloxiran-2-yl)prop-1-en-1-ol

Drug info:

PubChemData

Smile

[Li+].CC(=C(C1C(O1)C2=CC=CC=C2)[O-])C

DOS

IR

Vibrations