Geometry & MOs

Info

ID:	285543
PubChem CID:	104110975
Reduced:	BrNOC13H24 (1)
Stoich.:	ABCD13E24 (1)
Weight, g/mol:	329.046412
ΔH_f, kcal/mol:	-100.44
Dipole, Da:	4.04
IP(EA), eV:	-9.88(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-chloropentan-2-yl)-3-(trifluoromethyl)benzenesulfonamide

Drug info:

PubChemData

Smile

CCC1(CCCC1)C(=O)NC(C)CC(C)Br

DOS

IR

Vibrations