Geometry & MOs

Info

ID:	394968
PubChem CID:	135024325
Reduced:	FN3O3C13H14 (1)
Stoich.:	AB3C3D13E14 (1)
Weight, g/mol:	575.352391
ΔH_f, kcal/mol:	24.28
Dipole, Da:	4.29
IP(EA), eV:	-9.68(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	-4

Chem-info

IUPAC name:

benzene;cobalt;4,5-dimethyl-1,3-di(propan-2-yl)-2H-imidazol-2-ide

Drug info:

PubChemData

Smile

C1C2[C@@H](C(C([C@H](O1)O2)N=[N+]=[N-])F)OCC3=CC=CC=C3

DOS

IR

Vibrations