Geometry & MOs

Info

ID:	404745
PubChem CID:	135070388
Reduced:	PC9O10H17 (1)
Stoich.:	AB9C10D17 (1)
Weight, g/mol:	318.071584
ΔH_f, kcal/mol:	-410.22
Dipole, Da:	2.56
IP(EA), eV:	-9.78(-1.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R,3R,4R,5R,6S)-2,3,4,5,6-pentahydroxy-7-oxononyl] dihydrogen phosphate

Drug info:

PubChemData

Smile

CCC(=O)[C@H]([C@@H]([C@@H]([C@@H]([C@@H](COP(=O)([O-])[O-])O)O)O)O)O

DOS

IR

Vibrations