Geometry & MOs

Info

ID:	231097
PubChem CID:	87572634
Reduced:	NPSC20H42 (1)
Stoich.:	ABCD20E42 (1)
Weight, g/mol:	359.277559
ΔH_f, kcal/mol:	-79.65
Dipole, Da:	16.99
IP(EA), eV:	-7.33(0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[trihexyl(methyl)-lambda5-phosphanyl] thiocyanate

Drug info:

PubChemData

Smile

CCCCCC[P+](C)(CCCCCC)CCCCCC.C(#N)[S-]

DOS

IR

Vibrations