Geometry & MOs

Info

ID:	200764
PubChem CID:	79440006
Reduced:	FNCl2H16C17 (1)
Stoich.:	ABC2D16E17 (1)
Weight, g/mol:	312.03611
ΔH_f, kcal/mol:	-24.98
Dipole, Da:	1.65
IP(EA), eV:	-9.24(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-bromophenyl)-3-(1-hydroxycyclopentyl)propanoic acid

Drug info:

PubChemData

Smile

C1CNCC(C1C2=CC(=C(C=C2)Cl)Cl)C3=CC=CC=C3F

DOS

IR

Vibrations