Geometry & MOs

Info

ID:	272950
PubChem CID:	103768607
Reduced:	SN2O3C15H20 (1)
Stoich.:	AB2C3D15E20 (1)
Weight, g/mol:	366.99115
ΔH_f, kcal/mol:	-88.21
Dipole, Da:	2.52
IP(EA), eV:	-9.87(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-4-methyl-N-[1-(oxan-4-yl)ethyl]thiophene-2-sulfonamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C#N)S(=O)(=O)NC(C)C2CCOCC2

DOS

IR

Vibrations