Geometry & MOs

Info

ID:	252331
PubChem CID:	103110627
Reduced:	SN2O3C13H20 (1)
Stoich.:	AB2C3D13E20 (1)
Weight, g/mol:	373.97583
ΔH_f, kcal/mol:	-118.99
Dipole, Da:	2.53
IP(EA), eV:	-8.52(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-amino-2-methylphenyl)methyl]-5-bromo-4-methylthiophene-2-sulfonamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1N)CNS(=O)(=O)CC2CCCO2

DOS

IR

Vibrations