Geometry & MOs

Info

ID:	299333
PubChem CID:	117682669
Reduced:	PO5C6H11 (2)
Stoich.:	AB5C6D11 (2)
Weight, g/mol:	416.100121
ΔH_f, kcal/mol:	-581.84
Dipole, Da:	3.38
IP(EA), eV:	-10.13(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,12-dihydroxy-8,9,17,18-tetramethyl-2,4,7,11,13,16-hexaoxa-3lambda5,12lambda5-diphosphatricyclo[13.2.1.06,10]octadecane 3,12-dioxide

Drug info:

PubChemData

Smile

CC1CC2C(O1)COP(=O)(OC3CC(COP(=O)(O2)O)OC3C)O

DOS

IR

Vibrations