Geometry & MOs

Info

ID:	412189
PubChem CID:	135085064
Reduced:	NC18H18 (2)
Stoich.:	AB18C18 (2)
Weight, g/mol:	481.05617
ΔH_f, kcal/mol:	123.54
Dipole, Da:	0.54
IP(EA), eV:	-9.13(0.21)
Spin(S_z, S²):	None, None
Charge, e:	-2

Chem-info

IUPAC name:

[(1S,2S)-2-azanidyl-1,2-diphenylethyl]-methylsulfonylazanide;iridium

Drug info:

PubChemData

Smile

C1C[C@H](C([C@@H]1C2=CC=CC=C2)N=CC=NC3[C@@H](CC[C@H]3C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6

DOS

IR

Vibrations