Geometry & MOs

Info

ID:	200759
PubChem CID:	79439393
Reduced:	FO3C15H19 (1)
Stoich.:	AB3C15D19 (1)
Weight, g/mol:	222.105608
ΔH_f, kcal/mol:	-176.07
Dipole, Da:	4.62
IP(EA), eV:	-9.69(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyclopropyl-2-(2-fluorophenyl)butanoic acid

Drug info:

PubChemData

Smile

C1CC(OC1)CCCC(C2=CC=CC=C2F)C(=O)O

DOS

IR

Vibrations