Geometry & MOs

Info

ID:	337494
PubChem CID:	127258117
Reduced:	PO5C18H31 (1)
Stoich.:	AB5C18D31 (1)
Weight, g/mol:	398.128311
ΔH_f, kcal/mol:	-305.77
Dipole, Da:	2.15
IP(EA), eV:	-8.27(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[ethoxy(ethyl)phosphoryl]oxy-2,5-diphenylbenzene-1,4-diol

Drug info:

PubChemData

Smile

CCOP(=O)(C1=C(C=C(C(=C1C(C)(C)C)O)C(C)(C)C)O)OCC

DOS

IR

Vibrations