Geometry & MOs

Info

ID:	382504
PubChem CID:	134973710
Reduced:	PO7H39C42 (1)
Stoich.:	AB7C39D42 (1)
Weight, g/mol:	540.251189
ΔH_f, kcal/mol:	-143.74
Dipole, Da:	7.3
IP(EA), eV:	-8.5(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-4-[(2R,5R)-6-methyl-3,4,5-tris(phenylmethoxy)oxan-2-yl]benzene-1,3-diol

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1OC)C2=CC=C(C=C2)P(=O)(C3=CC=C(C=C3)C4=C(C(=CC=C4)OC)OC)C5=CC=C(C=C5)C6=C(C(=CC=C6)OC)OC

DOS

IR

Vibrations