Geometry & MOs

Info

ID:	230063
PubChem CID:	87569992
Reduced:	NO6C20H25 (1)
Stoich.:	AB6C20D25 (1)
Weight, g/mol:	2020.476505
ΔH_f, kcal/mol:	-184.69
Dipole, Da:	3.71
IP(EA), eV:	-8.81(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,2-bis(3,4-didodecoxyphenyl)ethene-1,2-dithiol;nickel

Drug info:

PubChemData

Smile

CC(=NOCCCCC1COC(OC1)(C)C(=O)O)C2=CC3=CC=CC=C3O2

DOS

IR

Vibrations