Geometry & MOs

Info

ID:	386199
PubChem CID:	134981046
Reduced:	NS2C15H15 (1)
Stoich.:	AB2C15D15 (1)
Weight, g/mol:	336.016007
ΔH_f, kcal/mol:	72.33
Dipole, Da:	1.48
IP(EA), eV:	-8.19(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

carbanide;dioxorhenium;ethynylbenzene

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)S/C=C(/CN)\SC2=CC=CC=C2

DOS

IR

Vibrations