Geometry & MOs

Info

ID:

340038

PubChem CID:

127262047

Reduced:

O5N11C34H45 (1)

Stoich.:

A5B11C34D45 (1)

Weight, g/mol:

364.151172

ΔHf, kcal/mol:

-132.45

Dipole, Da:

3.56

IP(EA), eV:

 -9.05(-0.68)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[(1S)-1-[[(2S)-1-amino-1-oxopropan-2-yl]-[(2S)-2-[[2-(cyclopropylamino)acetyl]amino]propanoyl]amino]ethyl]phosphonic acid

Drug info:

PubChemData

Smile

C[C@@H](C(=O)N)N(C1=CC2=CC=CC=C2C=C1)C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CCCN=C(N)N)NC(=O)CNC(=O)C3=CC=CC=C3

DOS

IR

Vibrations