Geometry & MOs

Info

ID:	167955
PubChem CID:	74904942
Reduced:	ClSN3O5H24C25 (1)
Stoich.:	ABC3D5E24F25 (1)
Weight, g/mol:	509.078775
ΔH_f, kcal/mol:	-123.28
Dipole, Da:	5.97
IP(EA), eV:	-8.74(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(2-chlorophenyl)methyl-methylsulfonylamino]-N-[[3-(trifluoromethyl)phenyl]methylideneamino]benzamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NN=CC2=CC=C(C=C2)OC(=O)C)C3=C(C=C(C=C3)Cl)C

DOS

IR

Vibrations