Geometry & MOs

Info

ID:	153865
PubChem CID:	56313196
Reduced:	S2N3O3C24H27 (1)
Stoich.:	A2B3C3D24E27 (1)
Weight, g/mol:	466.076947
ΔH_f, kcal/mol:	-41.09
Dipole, Da:	7.69
IP(EA), eV:	-8.72(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-methylphenyl)-2-[(quinoline-2-carbonylamino)carbamoyl]thiophene-3-sulfonamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)NS(=O)(=O)C2=C(SC=C2)C(=O)N3CCCN(CC3)CC4=CC=CC=C4

DOS

IR

Vibrations