Geometry & MOs

Info

ID:	374084
PubChem CID:	131323539
Reduced:	ClNSO4C8H8 (1)
Stoich.:	ABCD4E8F8 (1)
Weight, g/mol:	283.92084
ΔH_f, kcal/mol:	-133.15
Dipole, Da:	4.58
IP(EA), eV:	-11.24(-2.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-bromo-2-fluoro-4-(trifluoromethoxy)pyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CCOC(=O)C1=NC=C(C=C1)S(=O)(=O)Cl

DOS

IR

Vibrations