Geometry & MOs

Info

ID:	17296
PubChem CID:	491975
Reduced:	S2O3N4C19H20 (1)
Stoich.:	A2B3C4D19E20 (1)
Weight, g/mol:	416.097683
ΔH_f, kcal/mol:	-45.96
Dipole, Da:	3.92
IP(EA), eV:	-8.87(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-1-[4-methyl-5-(methylsulfamoyl)-1,3-thiazol-2-yl]-3-(4-phenylphenyl)urea

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)N(C)C(=O)NC2=CC=C(C=C2)C3=CC=CC=C3)S(=O)(=O)NC

DOS

IR

Vibrations