Geometry & MOs

Info

ID:

219839

PubChem CID:

85164949

Reduced:

SiO6C36H48 (1)

Stoich.:

AB6C36D48 (1)

Weight, g/mol:

604.117682

ΔHf, kcal/mol:

-252.76

Dipole, Da:

1.11

IP(EA), eV:

 -8.75(0.11)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[1-[[4-[N-methoxy-C-[[2-[1-(2-methylpropanoyloxy)ethoxycarbonyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-7-yl]carbamoyl]carbonimidoyl]-1,3-thiazol-2-yl]amino]-1-oxopropan-2-yl]azanium;chloride

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C)(C)OC1C(C(C(OC12CCCO2)COCC3=CC=CC=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5

DOS

IR

Vibrations