Geometry & MOs

Info

ID:	337483
PubChem CID:	127258106
Reduced:	PO3C26H37 (1)
Stoich.:	AB3C26D37 (1)
Weight, g/mol:	402.195996
ΔH_f, kcal/mol:	-196.12
Dipole, Da:	2.37
IP(EA), eV:	-8.9(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methoxy-4-[[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxy-phenylphosphoryl]oxybenzene

Drug info:

PubChemData

Smile

C[C@@H]1CC[C@H]([C@@H](C1)OP(=O)(C2=CC=CC=C2)OC3=CC=C(C=C3)C(C)(C)C)C(C)C

DOS

IR

Vibrations