Geometry & MOs

Info

ID:	225457
PubChem CID:	85786972
Reduced:	HgC6H7 (1)
Stoich.:	AB6C7 (1)
Weight, g/mol:	236.159872
ΔH_f, kcal/mol:	65.84
Dipole, Da:	4.23
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.765677
Charge, e:	0

Chem-info

IUPAC name:

9-ethyl-2,3,4,4a,5,6,7,8,8a,10a-decahydro-1H-thioxanthene

Drug info:

PubChemData

Smile

C1=CC(C=C1)C[Hg]

DOS

IR

Vibrations