Geometry & MOs

Info

ID:

412391

PubChem CID:

135085282

Reduced:

MnN2O2C36H54 (1)

Stoich.:

AB2C2D36E54 (1)

Weight, g/mol:

2637.365774

ΔHf, kcal/mol:

-53.28

Dipole, Da:

3.42

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 1.952388

Charge, e:

 0

Chem-info

IUPAC name:

bis(trifluoromethylsulfonyl)azanide;gold(1+);tris[2-tris(3,5-ditert-butyl-4-methoxyphenyl)silylethynyl]phosphane

Drug info:

PubChemData

Smile

CC(C1=C/C(=C/N[C@H]2[C@@H](CCCC2)N/C=C/3\C(=O)C(=CC(=C3)C(C)(C)C)C(C)(C)C)/C(=O)C(=C1)C(C)(C)C)(C)C.[Mn+3]

DOS

IR

Vibrations