Geometry & MOs

Info

ID:	232716
PubChem CID:	87576799
Reduced:	NOC10H11 (2)
Stoich.:	ABC10D11 (2)
Weight, g/mol:	549.06424
ΔH_f, kcal/mol:	-44.74
Dipole, Da:	3.94
IP(EA), eV:	-8.44(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

1-cyclopenta-1,3-dien-1-yl-2,7-dimethyl-9H-fluoren-9-ide;propan-2-ylidenehafnium(2+);dichloride

Drug info:

PubChemData

Smile

CCC1=C(C(=C(C(=C1OC)C2=CNC3=CC=CC=C32)C)C)C(=O)N

DOS

IR

Vibrations