Geometry & MOs

Info

ID:	337505
PubChem CID:	127258128
Reduced:	PO5C15H19 (1)
Stoich.:	AB5C15D19 (1)
Weight, g/mol:	402.195996
ΔH_f, kcal/mol:	-261.31
Dipole, Da:	2.92
IP(EA), eV:	-8.36(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOP(=O)(OCC)OC1=CC(=C(C2=CC=CC=C21)O)C

DOS

IR

Vibrations