Geometry & MOs

Info

ID:

219984

PubChem CID:

85165113

Reduced:

N2O9H34C35 (1)

Stoich.:

A2B9C34D35 (1)

Weight, g/mol:

626.308066

ΔHf, kcal/mol:

-297.96

Dipole, Da:

5.18

IP(EA), eV:

 -9.58(-0.82)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[1-[[4-(benzylamino)-2-[[3-methyl-2-(3-methylbutanoylamino)butanoyl]amino]-4-oxobutanoyl]amino]-3-methylbutyl]-(2-methoxy-2-oxoethoxy)phosphinic acid

Drug info:

PubChemData

Smile

C1CCC2(CC1)OC3C(C(C4C(C3O2)N(C(=O)O4)C(=O)C5=CC=CC=C5)OC(=O)C6=CC=CC=C6)NC(=O)OCC7=CC=CC=C7

DOS

IR

Vibrations