Geometry & MOs

Info

ID:	403267
PubChem CID:	135059453
Reduced:	NO5C13H19 (1)
Stoich.:	AB5C13D19 (1)
Weight, g/mol:	375.071918
ΔH_f, kcal/mol:	-211.79
Dipole, Da:	2.75
IP(EA), eV:	-8.75(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	-2

Chem-info

IUPAC name:

[(3R,4S,5S)-3,4-dihydroxy-2-oxo-5-(phenylmethoxycarbonylamino)hexyl] phosphate

Drug info:

PubChemData

Smile

CCC(C)OC1=C(C=CC(=C1C(=O)NCCO)O)O

DOS

IR

Vibrations