Geometry & MOs

Info

ID:

226237

PubChem CID:

87350204

Reduced:

NPC5O6H13 (1)

Stoich.:

ABC5D6E13 (1)

Weight, g/mol:

196.037484

ΔHf, kcal/mol:

-290.07

Dipole, Da:

6.7

IP(EA), eV:

0.0(0.0)

Spin(Sz, S2):

0.500000, 0.762358

Charge, e:

1

Chem-info

IUPAC name:

[(2S)-2-amino-3-hydroxypropanoyl]oxy-ethoxy-oxophosphanium

Drug info:

PubChemData

Smile

CCO[P+](=O)O.C([C@@H](C(=O)O)N)O

DOS

IR

Vibrations