Geometry & MOs

Info

ID:	178473
PubChem CID:	76334550
Reduced:	S2Cl3N4O6C14H15 (1)
Stoich.:	A2B3C4D6E14F15 (1)
Weight, g/mol:	430.072925
ΔH_f, kcal/mol:	-207.32
Dipole, Da:	2.44
IP(EA), eV:	-9.13(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4,6-dimethoxypyrimidin-2-yl)-3-[3-[(methylcarbamoylamino)methyl]thiophen-2-yl]sulfonylurea

Drug info:

PubChemData

Smile

COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=C(C=CS2)COCC(Cl)(Cl)Cl)OC

DOS

IR

Vibrations