Geometry & MOs

Info

ID:	54041
PubChem CID:	14719698
Reduced:	SO5N6C15H20 (1)
Stoich.:	AB5C6D15E20 (1)
Weight, g/mol:	403.017574
ΔH_f, kcal/mol:	-142.96
Dipole, Da:	7.74
IP(EA), eV:	-10.09(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-chloro-6-methoxypyrimidin-2-yl)-3-[3-(methylsulfanylmethyl)pyridin-2-yl]sulfonylurea

Drug info:

PubChemData

Smile

CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(C=CC=N2)C(C(C)C)O

DOS

IR

Vibrations