Geometry & MOs

Info

ID:	154707
PubChem CID:	56314213
Reduced:	ClO2N4C25H25 (1)
Stoich.:	AB2C4D25E25 (1)
Weight, g/mol:	416.061297
ΔH_f, kcal/mol:	35.05
Dipole, Da:	4.17
IP(EA), eV:	-9.0(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)C(C)C(=O)N(C)CC2=CN(N=C2C3=CC=C(C=C3)Cl)C4=CC=CC=C4

DOS

IR

Vibrations