la(me)3r

la(me)3r 6365 Trimethyl lanthanum (Geo)

#	Species	Formula
6355	Barium monochloride	ClBa
6356	Barium dichloride (Geo)	Cl2Ba
6357	Barium dichloride	Cl2Ba
6358	Barium dibromide (Geo)	Br2Ba
6359	Barium dibromide	Br2Ba
6360	Barium monoiodide	IBa
6361	Barium diiodide (Geo)	I2Ba
6362	Barium diiodide	I2Ba
6363	Lanthanum, cation	La
6364	Lanthanum, atom	La
6365	Trimethyl lanthanum (Geo)	C3H9La
6366	Trimethyl lanthanum	C3H9La
6367	Tricyclopentadienyl lanthanum(III)	C15H15La
6368	Lanthanum(II) tetracyanide 2E	C4N4La
6369	La(II)(NH3)6	H18N6La
6370	La(II)(NH3)6 (Geo)	H18N6La
6371	Lanthanum complex, CCDC: XONXUT (Geo)	C45H33N9La
6372	Lanthanum complex, CCDC: ZAZQAS (Geo)	C76H44N12La
6373	Lanthanum complex, CCDC: ZEHTUB (Geo)	C64H32N16La
6374	Lanthanum complex, CCDC: TUPWEG (Geo)	C72H40N16La
6375	Lanthanum complex, CCDC: EGOBAD (Geo)	C27H30B3N18La

REF: Estimated from DGauss results of DFT calculations, using the B88-PW91 functional and the DZVP basis set, in CAChe 6.0, Fujitsu Ltd, 2003.

  
 PM7
Trimethyl lanthanum
 <La-C> <> <C-La-C> GR=PW91D
  C     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
 La     2.44710500 +1    0.0000000 +0    0.0000000 +0     1     0     0
  C     2.36896797 +1  111.9555650 +1    0.0000000 +0     2     1     0
  C     2.37546523 +1  124.4454447 +1 -177.1519991 +1     2     1     3
  H     1.06506359 +1  105.6940580 +1   33.6687636 +1     1     2     3
  H     1.06458461 +1  107.5411165 +1  120.4798580 +1     1     2     5
  H     1.06460295 +1  106.5340961 +1  120.3284881 +1     1     2     6
  H     1.06631763 +1  107.6825235 +1 -111.0056449 +1     3     2     1
  H     1.06737848 +1  105.2164049 +1  119.6637559 +1     3     2     8
  H     1.06617438 +1  107.8551811 +1  120.1082173 +1     3     2     9
  H     1.06613570 +1  107.2535711 +1  152.2966022 +1     4     2     1
  H     1.06579254 +1  106.9811240 +1  119.9338410 +1     4     2    11
  H     1.06621376 +1  106.7171206 +1  119.5759396 +1     4     2    12