Geometry & MOs

Info

ID:

219759

PubChem CID:

85164860

Reduced:

Si2O4C35H52 (1)

Stoich.:

A2B4C35D52 (1)

Weight, g/mol:

593.183186

ΔHf, kcal/mol:

-240.18

Dipole, Da:

1.37

IP(EA), eV:

 -8.74(0.17)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

benzhydryl 3-[(1-hydroxy-2-oxopyrrolidin-3-ylidene)methyl]-7-[(2-methylpropan-2-yl)oxycarbonylamino]-5,8-dioxo-5lambda4-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C)(C)OCCCC(COCC1=CC=C(C=C1)OC)O[Si](C2=CC=CC=C2)(C3=CC=CC=C3)C(C)(C)C

DOS

IR

Vibrations