Geometry & MOs

Info

ID:	294337
PubChem CID:	117453561
Reduced:	N2F3C15H17 (1)
Stoich.:	A2B3C15D17 (1)
Weight, g/mol:	282.126737
ΔH_f, kcal/mol:	-139.81
Dipole, Da:	2.73
IP(EA), eV:	-8.92(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(5-fluoro-3-methoxy-2-propan-2-yloxyphenyl)cyclopropyl]acetic acid

Drug info:

PubChemData

Smile

C1CCC(CC1)(C2=C3C=C(NC3=CC=C2)C(F)(F)F)N

DOS

IR

Vibrations