Geometry & MOs

Info

ID:

84087

PubChem CID:

49864080

Reduced:

O7N8C43H66 (1)

Stoich.:

A7B8C43D66 (1)

Weight, g/mol:

460.161068

ΔHf, kcal/mol:

-334.38

Dipole, Da:

3.32

IP(EA), eV:

 -9.31(0.0)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

methyl (2R)-2-[[[(4R,5R)-5-(hydroxycarbamoyl)-2,2-dimethyl-1,3-dioxolan-4-yl]methoxy-phenoxyphosphoryl]amino]-3-methylbutanoate

Drug info:

PubChemData

Smile

C[C@@H](C(=O)N)N(C)C(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CC2=CC=CC=C2)N(C)C(=O)[C@H](C(C)C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CCCCN)NC(=O)C

DOS

IR

Vibrations