Geometry & MOs

Info

ID:	21479
PubChem CID:	588598
Reduced:	S6C7H10 (1)
Stoich.:	A6B7C10 (1)
Weight, g/mol:	285.910677
ΔH_f, kcal/mol:	51.84
Dipole, Da:	1.08
IP(EA), eV:	-8.96(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-propyl-2,4,6,8,9,10-hexathiatricyclo[3.3.1.13,7]decane

Drug info:

PubChemData

Smile

CCCC12SC3SC(S1)SC(S3)S2

DOS

IR

Vibrations