Geometry & MOs

Info

ID:	225097
PubChem CID:	85741745
Reduced:	ON3C8H10 (2)
Stoich.:	AB3C8D10 (2)
Weight, g/mol:	287.86619
ΔH_f, kcal/mol:	37.58
Dipole, Da:	6.33
IP(EA), eV:	-9.43(-2.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-2,3,3-trifluoro-3-iodopropanoic acid

Drug info:

PubChemData

Smile

C1COCCN1CC2=C(N=C(C(=N2)C#N)C#N)CN3CCOCC3

DOS

IR

Vibrations