Geometry & MOs

Info

ID:

403927

PubChem CID:

135062660

Reduced:

NSiO4C24H39 (1)

Stoich.:

ABC4D24E39 (1)

Weight, g/mol:

362.172939

ΔHf, kcal/mol:

-183.02

Dipole, Da:

1.89

IP(EA), eV:

 -8.85(0.41)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(3aR,5S,6S,6aR)-5-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-6-[(E)-2-phenylethenoxy]-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxole

Drug info:

PubChemData

Smile

CC1(OC[C@@H](O1)C(C2=CCCCO2)N(CC3=CC=CC=C3)O[Si](C)(C)C(C)(C)C)C

DOS

IR

Vibrations