Geometry & MOs

Info

ID:	384187
PubChem CID:	134976496
Reduced:	BrSC2H4 (3)
Stoich.:	ABC2D4 (3)
Weight, g/mol:	180.010114
ΔH_f, kcal/mol:	23.07
Dipole, Da:	3.68
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 1.649445
Charge, e:	0

Chem-info

IUPAC name:

1,2,3-tris(methylsulfanyl)cyclopropane

Drug info:

PubChemData

Smile

CSC1C(C1SC)SC.Br[Br-]Br

DOS

IR

Vibrations