Geometry & MOs

Info

ID:	230593
PubChem CID:	87571444
Reduced:	O3C8H18 (1)
Stoich.:	A3B8C18 (1)
Weight, g/mol:	710.195756
ΔH_f, kcal/mol:	-181.02
Dipole, Da:	1.3
IP(EA), eV:	-10.99(0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

diethoxy-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxy-sulfanylidene-lambda5-phosphane;oxetan-3-yl 2-[(4,6-dimethylpyrimidin-2-yl)carbamoylsulfamoyl]benzoate

Drug info:

PubChemData

Smile

CCCCCCOC(=O)C.O

DOS

IR

Vibrations