Geometry & MOs

Info

ID:	180084
PubChem CID:	76574060
Reduced:	Cl2N2O6C21H26 (1)
Stoich.:	A2B2C6D21E26 (1)
Weight, g/mol:	567.17493
ΔH_f, kcal/mol:	-227.7
Dipole, Da:	2.52
IP(EA), eV:	-9.79(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

2-(3,5-dimethylbenzene-6-id-1-yl)-3,5,6-trimethylquinoline;4-hydroxypent-3-en-2-one;iridium

Drug info:

PubChemData

Smile

CC(C)CC(C(=O)C1(CO1)CO)NC(=O)C(CO)NC(=O)C=CC2=C(C=C(C=C2)Cl)Cl

DOS

IR

Vibrations