Geometry & MOs

Info

ID:

82079

PubChem CID:

49855570

Reduced:

NSiO7C38H45 (1)

Stoich.:

ABC7D38E45 (1)

Weight, g/mol:

570.200216

ΔHf, kcal/mol:

-227.05

Dipole, Da:

4.92

IP(EA), eV:

 -8.34(-0.2)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(3R,4S)-4-(4-methoxy-3-nitrophenyl)-3-(4-phenylmethoxyphenyl)-1-(3,4,5-trimethoxyphenyl)azetidin-2-one

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C)(C)OC1=C(C=CC(=C1)[C@@H]2[C@H](C(=O)N2C3=CC(=C(C(=C3)OC)OC)OC)C4=CC=C(C=C4)OCC5=CC=CC=C5)OC

DOS

IR

Vibrations