Geometry & MOs

Info

ID:	294338
PubChem CID:	117453625
Reduced:	FO4C15H19 (1)
Stoich.:	AB4C15D19 (1)
Weight, g/mol:	282.126737
ΔH_f, kcal/mol:	-190.89
Dipole, Da:	5.37
IP(EA), eV:	-9.46(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(1-fluoroethyl)-2,5-dimethoxyphenyl]cyclobutane-1-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)OC1=C(C=C(C=C1OC)F)C2(CC2)CC(=O)O

DOS

IR

Vibrations