Geometry & MOs

Info

ID:	427015
PubChem CID:	135155027
Reduced:	ClO2F3C10H10 (1)
Stoich.:	AB2C3D10E10 (1)
Weight, g/mol:	543.259643
ΔH_f, kcal/mol:	-237.57
Dipole, Da:	3.43
IP(EA), eV:	-9.33(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclopropyl-3-[1'-[[5-cyclopropyl-2-(trifluoromethoxy)phenyl]methyl]spiro[3,4-dihydrochromene-2,4'-piperidine]-7-yl]-2-methylpropanoic acid

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1Cl)CCO)OCC(F)(F)F

DOS

IR

Vibrations