Geometry & MOs

Info

ID:	181973
PubChem CID:	76822104
Reduced:	FNO5C32H46 (1)
Stoich.:	ABC5D32E46 (1)
Weight, g/mol:	471.278487
ΔH_f, kcal/mol:	-280.65
Dipole, Da:	2.94
IP(EA), eV:	-8.62(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-[1-[3-[2-[(3-fluoro-4-methylphenyl)methyl]pyrrolidin-1-yl]-2-hydroxypropoxy]ethyl]phenyl]-2,2-dimethylpropanoic acid

Drug info:

PubChemData

Smile

CCOC1=CC(=C(C=C1)CCCCC(=O)OCC)C(C)OCC(CN2CCCC2CC3=CC(=C(C=C3)C)F)O

DOS

IR

Vibrations