Geometry & MOs

Info

ID:	179603
PubChem CID:	76509293
Reduced:	O3C30H46 (1)
Stoich.:	A3B30C46 (1)
Weight, g/mol:	165.96594
ΔH_f, kcal/mol:	-164.01
Dipole, Da:	1.13
IP(EA), eV:	-8.67(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,6-bis(sulfanylidene)pyridine-2-carbonitrile

Drug info:

PubChemData

Smile

CC(C=CC(C1CCCCC1)O)C2CCC3C2(CCCC3=CC=C4CC(CC(C4=C)O)O)C

DOS

IR

Vibrations