Geometry & MOs

Info

ID:

46800

PubChem CID:

10527433

Reduced:

ClNO6C23H26 (1)

Stoich.:

ABC6D23E26 (1)

Weight, g/mol:

448.152825

ΔHf, kcal/mol:

-255.59

Dipole, Da:

5.19

IP(EA), eV:

 -8.49(-0.64)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

methyl (2S)-2-[2-[[1-[(2S)-1-methoxy-3-methyl-1-oxobutan-2-yl]-2-oxo-5H-1,2lambda5-azaphosphol-2-yl]oxy]-2-oxo-5H-1,2lambda5-azaphosphol-1-yl]-3-methylbutanoate

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C3=C(N2CCCCC[C@H](C[C@](CC(=O)O)(C(=O)O)O)O)C=CC(=C3)Cl

DOS

IR

Vibrations