Hexaphenylbenzene xtal perspective
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Structure of hexaphenylbenzene. Coordinates used to generate this molecule from (1968). "The crystal structure of a modification of hexaphenylbenzene". Acta Crystallographica, Section B: Structural Crystallography and Crystal Chemistry 24 (10): 1277. DOI:10.1107/S0567740868004176.
are as follows:
c(1) 2.533 8.451 1.323 c(2) 2.603 9.383 0.277 c(3) 2.495 8.942 -1.047 c(4) 2.306 7.604 -1.325 c(5) 2.176 6.655 -0.306 c(6) 2.268 7.097 1.052 C(1A) 2.742 8.889 2.751 C(2A) 1.838 9.687 3.412 C(3A) 2.102 10.063 4.750 C(4A) 3.269 9.617 5.382 C(5A) 4.161 8.836 4.704 C(6A) 3.904 8.452 3.388 C(1B) 2.823 10.819 0.588 C(2B) 1.742 11.717 0.319 C(3B) 1.984 13.120 0.677 C(4B) 3.193 13.492 1.262 C(5B) 4.248 12.573 1.478 C(6B) 4.027 11.235 1.152 C(1C) 2.584 9.935 -2.184 C(2C) 1.474 10.144 -3.015 C(3C) 1.542 11.054 -4.049 C(4C) 2.705 11.819 -4.250 C(5C) 3.808 11.627 -3.407 C(6C) 3.748 10.684 -2.375 C(1D) 2.350 7.138 -2.783 C(2D) 1.187 6.717 -3.412 C(3D) 1.208 6.361 -4.771 C(4D) 2.425 6.464 -5.456 C(5D) 3.635 6.853 -4.804 C(6D) 3.568 7.200 -3.465 C(1E) 1.930 5.231 -0.591 C(2E) 0.714 4.639 -0.225 C(3E) 0.487 3.295 -0.489 C(4E) 1.437 2.528 -1.125 C(5E) 2.671 3.088 -1.480 C(6E) 2.916 4.455 -1.215 C(1F) 2.046 6.128 2.152 C(2F) 0.940 6.275 2.990 C(3F) 0.692 5.368 4.018 C(4F) 1.616 4.307 4.243 C(5F) 2.754 4.191 3.427 C(6F) 2.951 5.081 2.373
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