Geometry & MOs

Info

ID:	283564
PubChem CID:	103989135
Reduced:	BrINOC13H15 (1)
Stoich.:	ABCDE13F15 (1)
Weight, g/mol:	300.033541
ΔH_f, kcal/mol:	-19.88
Dipole, Da:	3.86
IP(EA), eV:	-9.62(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-4-cyano-N-(oxan-4-yl)benzenesulfonamide

Drug info:

PubChemData

Smile

C1CCC(C1)CNC(=O)C2=C(C=CC(=C2)I)Br

DOS

IR

Vibrations