Geometry & MOs

Info

ID:	373944
PubChem CID:	131321575
Reduced:	NO2C12H13 (1)
Stoich.:	AB2C12D13 (1)
Weight, g/mol:	370.84916
ΔH_f, kcal/mol:	-29.88
Dipole, Da:	7.28
IP(EA), eV:	-8.33(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-iodo-4-(trifluoromethyl)pyridine-3-sulfonyl chloride

Drug info:

PubChemData

Smile

CC1=CC(=CN1C)C2=C(OC(=C2)C=O)C

DOS

IR

Vibrations