Geometry & MOs

Info

ID:	25005
PubChem CID:	616505
Reduced:	ClPSN2O4C17H22 (1)
Stoich.:	ABCD2E4F17G22 (1)
Weight, g/mol:	416.072643
ΔH_f, kcal/mol:	-214.09
Dipole, Da:	5.55
IP(EA), eV:	-9.24(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(4-chlorophenyl)-6-(methoxymethyl)-5-methylpyrimidin-4-yl]oxy-diethoxy-sulfanylidene-lambda5-phosphane

Drug info:

PubChemData

Smile

CCOP(=S)(OCC)OC1=NC(=NC(=C1C)COC)C2=CC=C(C=C2)Cl

DOS

IR

Vibrations