Geometry & MOs

Info

ID:	26927
PubChem CID:	804406
Reduced:	ON2S2C13H14 (1)
Stoich.:	AB2C2D13E14 (1)
Weight, g/mol:	281.93838
ΔH_f, kcal/mol:	10.12
Dipole, Da:	1.62
IP(EA), eV:	-8.85(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-2-tert-butylsulfonylthiophene

Drug info:

PubChemData

Smile

CCN1C(=O)C(=CC2=CC=C(C=C2)SC)NC1=S

DOS

IR

Vibrations