Geometry & MOs

Info

ID:	401068
PubChem CID:	135049964
Reduced:	SO3C12H14 (1)
Stoich.:	AB3C12D14 (1)
Weight, g/mol:	200.076975
ΔH_f, kcal/mol:	-88.42
Dipole, Da:	4.68
IP(EA), eV:	-9.36(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(2-trimethylsilylethynyl)pyridine-2-carbonitrile

Drug info:

PubChemData

Smile

CC/C=C\C(C(=O)C1=CC=CS1)C(=O)OC

DOS

IR

Vibrations