Geometry & MOs

Info

ID:

232725

PubChem CID:

87576819

Reduced:

O2N3C22H27 (1)

Stoich.:

A2B3C22D27 (1)

Weight, g/mol:

929.445228

ΔHf, kcal/mol:

8.11

Dipole, Da:

7.75

IP(EA), eV:

 -9.21(-2.26)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[(2S)-1-[[(2R,4S,5S)-5-[[(2S)-2-[3-[[6-(2-hydroxypropan-2-yl)pyridin-2-yl]methyl]-2-oxoimidazolidin-1-yl]-3,3-dimethylbutanoyl]amino]-6-phenyl-4-phosphonooxy-1-(4-pyridin-2-ylphenyl)hexan-2-yl]amino]-3,3-dimethyl-1-oxobutan-2-yl]carbamic acid

Drug info:

PubChemData

Smile

CCCC(C)C1(CCCCC1(C2=CC=C3C2=CC4=CN=NC4=C3)C(=O)N)O

DOS

IR

Vibrations