Geometry & MOs

Info

ID:	402927
PubChem CID:	135057897
Reduced:	NPO9C14H18 (1)
Stoich.:	ABC9D14E18 (1)
Weight, g/mol:	377.087568
ΔH_f, kcal/mol:	-324.36
Dipole, Da:	2.19
IP(EA), eV:	-9.64(-1.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl N-[(2R,3S,4R)-3,4-dihydroxy-5-oxo-6-phosphonooxyhexan-2-yl]carbamate

Drug info:

PubChemData

Smile

C[C@H]([C@@H]([C@H](C(=O)COP(=O)([O-])[O-])O)O)NC(=O)OCC1=CC=CC=C1

DOS

IR

Vibrations