Geometry & MOs

Info

ID:	182960
PubChem CID:	76963918
Reduced:	O5C15H18 (2)
Stoich.:	A5B15C18 (2)
Weight, g/mol:	209.969556
ΔH_f, kcal/mol:	-443.31
Dipole, Da:	8.46
IP(EA), eV:	-8.91(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

potassium;1,3-dihydroxypropan-2-yl hydrogen phosphate

Drug info:

PubChemData

Smile

CC1=C(C(=C(C2=C1O[C@H](C2)CC(=O)O)C)OC(=O)C)C.CC1=C(C(=C(C2=C1O[C@@H](C2)CC(=O)O)C)OC(=O)C)C

DOS

IR

Vibrations