Geometry & MOs

Info

ID:	188167
PubChem CID:	77676618
Reduced:	NO5C14H23 (2)
Stoich.:	AB5C14D23 (2)
Weight, g/mol:	554.340306
ΔH_f, kcal/mol:	-336.9
Dipole, Da:	17.75
IP(EA), eV:	-8.07(-2.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-(7a-methyl-4-triethylsilyloxy-1,2,3,3a,4,5,6,7-octahydroinden-1-yl)-3-[4-(trifluoromethyl)phenyl]octanoic acid

Drug info:

PubChemData

Smile

CC1CC(C(=O)C(C2C(COC(=O)C(C(=O)C(C1OC3C(CC(OC3O)C)N(C)C)C)C)OC(=O)N2OC)C)C

DOS

IR

Vibrations