Geometry & MOs

Info

ID:	389687
PubChem CID:	134994448
Reduced:	S2O3C12H14 (1)
Stoich.:	A2B3C12D14 (1)
Weight, g/mol:	425.878063
ΔH_f, kcal/mol:	-48.54
Dipole, Da:	3.2
IP(EA), eV:	-8.13(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R,3R)-3-chloro-1-(trichloro-lambda4-tellanyl)pentan-2-yl] (E)-but-2-enoate

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C=C2[S@@](=O)CCC[S@@]2=O

DOS

IR

Vibrations