Geometry & MOs

Info

ID:	375303
PubChem CID:	131499883
Reduced:	NO2C13H17 (1)
Stoich.:	AB2C13D17 (1)
Weight, g/mol:	464.75459
ΔH_f, kcal/mol:	-85.82
Dipole, Da:	1.97
IP(EA), eV:	-9.41(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-3-iodo-5-(trifluoromethoxy)pyridine-4-sulfonyl chloride

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC=CC2=C1C[C@@H](CC2)N

DOS

IR

Vibrations