Geometry & MOs

Info

ID:	225473
PubChem CID:	85852484
Reduced:	ILiPC13H29 (1)
Stoich.:	ABCD13E29 (1)
Weight, g/mol:	234.011743
ΔH_f, kcal/mol:	-43.07
Dipole, Da:	8.07
IP(EA), eV:	-6.9(0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

acetic acid;(4-chlorophenyl)sulfanylmethanol

Drug info:

PubChemData

Smile

[Li+].CCCC[P+]([CH2-])(CCCC)CCCC.[I-]

DOS

IR

Vibrations