Geometry & MOs

Info

ID:	54038
PubChem CID:	14719684
Reduced:	SO4N5C14H17 (1)
Stoich.:	AB4C5D14E17 (1)
Weight, g/mol:	411.121255
ΔH_f, kcal/mol:	-111.09
Dipole, Da:	5.41
IP(EA), eV:	-9.48(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4,6-dimethoxypyrimidin-2-yl)-3-[3-(1-hydroxy-2-methylpropyl)pyridin-2-yl]sulfonylurea

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations