Geometry & MOs

Info

ID:	373169
PubChem CID:	131311033
Reduced:	ClSF2N2H3O5C6 (1)
Stoich.:	ABC2D2E3F5G6 (1)
Weight, g/mol:	287.941926
ΔH_f, kcal/mol:	-191.53
Dipole, Da:	2.85
IP(EA), eV:	-10.9(-2.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(difluoromethyl)-3-nitro-2-oxo-1H-pyridine-4-sulfonyl chloride

Drug info:

PubChemData

Smile

C1=C(NC(=O)C(=C1C(F)F)[N+](=O)[O-])S(=O)(=O)Cl

DOS

IR

Vibrations