Geometry & MOs

Info

ID:	312753
PubChem CID:	126607837
Reduced:	O5C18H22 (1)
Stoich.:	A5B18C22 (1)
Weight, g/mol:	516.183415
ΔH_f, kcal/mol:	-160.16
Dipole, Da:	3.56
IP(EA), eV:	-8.65(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[6-[(2,6-dichloro-3-ethylphenyl)methoxy]-2'-methylidenespiro[2H-1-benzofuran-3,5'-cycloheptane]-1'-yl]pentanoic acid

Drug info:

PubChemData

Smile

COC1=CC(=CC(=C1)C(C2=CC(=CC(=C2)OC)OC)OC)OC

DOS

IR

Vibrations