Geometry & MOs

Info

ID:	373553
PubChem CID:	131316989
Reduced:	BrISO2H6C10 (1)
Stoich.:	ABCD2E6F10 (1)
Weight, g/mol:	264.97291
ΔH_f, kcal/mol:	-27.27
Dipole, Da:	4.36
IP(EA), eV:	-9.36(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-5-(difluoromethyl)-3-fluoro-2-(trifluoromethoxy)pyridine

Drug info:

PubChemData

Smile

C1=C(C=C2C(=C1C(=O)O)C=C(S2)I)CBr

DOS

IR

Vibrations