Geometry & MOs

Info

ID:	58223
PubChem CID:	24434803
Reduced:	SN3O5C23H31 (1)
Stoich.:	AB3C5D23E31 (1)
Weight, g/mol:	478.167477
ΔH_f, kcal/mol:	-143.23
Dipole, Da:	9.72
IP(EA), eV:	-8.33(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-N-[3-[(E)-[[2-[methyl-(4-methylphenyl)sulfonylamino]acetyl]hydrazinylidene]methyl]phenyl]benzamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)N/N=C/C2=CC(=C(C=C2)OCCC(C)C)OC

DOS

IR

Vibrations