Geometry & MOs

Info

ID:	412041
PubChem CID:	135084904
Reduced:	NO4C17H31 (1)
Stoich.:	AB4C17D31 (1)
Weight, g/mol:	316.0803
ΔH_f, kcal/mol:	-239.32
Dipole, Da:	3.21
IP(EA), eV:	-10.26(0.16)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

carbanide;cycloocta-1,5-diene;iridium

Drug info:

PubChemData

Smile

C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)NC(CC(C)C)C(=O)O)C(C)C

DOS

IR

Vibrations