Geometry & MOs

Info

ID:

189427

PubChem CID:

77854114

Reduced:

SSi2O4N5C24H43 (1)

Stoich.:

AB2C4D5E24F43 (1)

Weight, g/mol:

689.415235

ΔHf, kcal/mol:

-293.31

Dipole, Da:

3.22

IP(EA), eV:

 -8.59(-0.48)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

benzyl N-[1-[[1-[[3-hydroxy-6-methyl-1-(2-methylbutylamino)-1-oxoheptan-4-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxo-3-quinolin-5-ylpropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CCSC1=NC(=C2C(=N1)N(C=N2)C3CC4C(O3)CO[Si](O[Si](O4)(C(C)C)C(C)C)(C(C)C)C(C)C)N

DOS

IR

Vibrations