Geometry & MOs

Info

ID:	51859
PubChem CID:	12014619
Reduced:	KSSeO6C23H39 (1)
Stoich.:	ABCD6E23F39 (1)
Weight, g/mol:	518.06436
ΔH_f, kcal/mol:	-239.22
Dipole, Da:	9.33
IP(EA), eV:	-7.72(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

potassium;1,4,7,10,13,16-hexaoxacyclooctadecane;(2-methylphenyl)-selanylidenemethanethiolate

Drug info:

PubChemData

Smile

C=CCC(CC=C)(CC=C)C(=[Se])[S-].C1COCCOCCOCCOCCOCCO1.[K+]

DOS

IR

Vibrations