Geometry & MOs

Info

ID:	216971
PubChem CID:	85087054
Reduced:	ClPS2C14H22 (1)
Stoich.:	ABC2D14E22 (1)
Weight, g/mol:	285.090055
ΔH_f, kcal/mol:	-4.24
Dipole, Da:	19.17
IP(EA), eV:	-7.04(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

(4,6-dimethyl-1,3-dithian-2-yl)-dimethyl-phenylphosphanium

Drug info:

PubChemData

Smile

CC1CC(SC(S1)[P+](C)(C)C2=CC=CC=C2)C.[Cl-]

DOS

IR

Vibrations