Geometry & MOs

Info

ID:

23016

PubChem CID:

600880

Reduced:

O2C13H18 (1)

Stoich.:

A2B13C18 (1)

Weight, g/mol:

206.13068

ΔHf, kcal/mol:

-46.62

Dipole, Da:

2.08

IP(EA), eV:

-8.72(0.24)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-[(4-butan-2-ylphenoxy)methyl]oxirane

Drug info:

PubChemData

Smile

CCC(C)C1=CC=C(C=C1)OCC2CO2

DOS

IR

Vibrations