American Mineralogist Crystal Structure Database

1 matching records for this search.

Hoganite
Download hom/hoganite.pdf
Meester P, Fletcher S R, Skapski A C
 
Dalton Transactions 1973 (1973) 2575-2578
Refined crystal structure of tetra-mu-acetato-bisaquodicopper (II)
Locality: synthetic
_database_code_amcsd 0012426
13.168 8.564 13.858 90 117.02 90 C2/c
atom      x      y      z Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
Cu   .45004 .08401 .04496      .00273 .00689 .00234 .00020 .00160 .00004
C1    .6824 -.0214  .1804       .0035  .0087  .0029 -.0001  .0017  .0005
C2    .7837 -.0380  .2888       .0046  .0189  .0034  .0027  .0008 -.0010
C3    .4332 -.2477  .0507       .0035  .0083  .0035 -.0011  .0015  .0010
C4    .3961 -.3963  .0836       .0061  .0096  .0061 -.0019  .0033  .0025
H1     .767  -.044   .357  1.5
H2     .843  -.088   .292  1.5
H3     .815   .069   .312  1.5
H4     .415  -.385   .162  1.5
H5     .439  -.481   .065  1.5
H6     .313  -.404   .048  1.5
H7      .39   .168   .195  1.5
H8     .318   .273   .108  1.5
O1    .6836 -.0881  .1006       .0028  .0104  .0026  .0009  .0014 -.0002
O2    .6000  .0603  .1759       .0032  .0103  .0024  .0011  .0012 -.0006
O3    .4922 -.2647 -.0003       .0058  .0069  .0052 -.0006  .0038  .0003
O4    .4054 -.1201  .0753       .0046  .0076  .0050 -.0002  .0033  .0013
Oh5   .3757  .2073  .1330       .0065  .0117  .0039  .0041  .0041  .0021
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