Geometry & MOs

Info

ID:

398609

PubChem CID:

135034247

Reduced:

O3C21H26 (1)

Stoich.:

A3B21C26 (1)

Weight, g/mol:

190.135765

ΔHf, kcal/mol:

-86.38

Dipole, Da:

4.34

IP(EA), eV:

-8.77(0.18)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(E,2R)-2-methyl-5-phenylhex-3-en-1-ol

Drug info:

PubChemData

Smile

C[C@@H](COCC1=CC=C(C=C1)OC)[C@@H](/C=C(\C)/C2=CC=CC=C2)O

DOS

IR

Vibrations