Geometry & MOs

Info

ID:	249275
PubChem CID:	103088264
Reduced:	BrNSC13H20 (1)
Stoich.:	ABCD13E20 (1)
Weight, g/mol:	410.88985
ΔH_f, kcal/mol:	-8.82
Dipole, Da:	2.91
IP(EA), eV:	-8.58(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-bromophenyl)methyl]-2,4-dichloro-3-fluorobenzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)Br)NCCCCSC)C

DOS

IR

Vibrations