Geometry & MOs

Info

ID:	316101
PubChem CID:	126630078
Reduced:	O7H28C32 (1)
Stoich.:	A7B28C32 (1)
Weight, g/mol:	550.199153
ΔH_f, kcal/mol:	-180.37
Dipole, Da:	3.03
IP(EA), eV:	-8.61(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[1-[4-(8-methoxydibenzofuran-2-yl)oxycarbonyloxyphenyl]cyclohexyl]phenyl] acetate

Drug info:

PubChemData

Smile

CCC(C)(C1=CC=C(C=C1)OC(=O)C)C2=CC=C(C=C2)OC(=O)OC3=CC4=C(C=C3)OC5=C4C=C(C=C5)OC

DOS

IR

Vibrations