Geometry & MOs

Info

ID:	38898
PubChem CID:	8138132
Reduced:	O2N3C15H15 (1)
Stoich.:	A2B3C15D15 (1)
Weight, g/mol:	412.120526
ΔH_f, kcal/mol:	-21.11
Dipole, Da:	2.27
IP(EA), eV:	-9.33(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dimethylphenyl)-4-[(1H-pyrrole-2-carbonylamino)carbamoyl]benzenesulfonamide

Drug info:

PubChemData

Smile

C1CC2=C(C1)C=C(C=C2)C(=O)NNC(=O)C3=CC=CN3

DOS

IR

Vibrations