Geometry & MOs

Info

ID:	249485
PubChem CID:	103089895
Reduced:	BrFNSCl2O2C12H13 (1)
Stoich.:	ABCDE2F2G12H13 (1)
Weight, g/mol:	358.971661
ΔH_f, kcal/mol:	-125.27
Dipole, Da:	3.86
IP(EA), eV:	-9.78(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-dichloro-N-(2-chloroethyl)-N-cyclobutyl-3-fluorobenzenesulfonamide

Drug info:

PubChemData

Smile

CC1CCN(C1CBr)S(=O)(=O)C2=C(C(=C(C=C2)Cl)F)Cl

DOS

IR

Vibrations