x | y | z | Uiso*/Ueq | ||
Cu | 0.209657 (18) | 0.90493 (2) | 0.156116 (9) | 0.02440 (7) | |
N1 | 0.21922 (12) | 0.80402 (17) | 0.05966 (6) | 0.0257 (3) | |
N2 | 0.42113 (13) | 0.89494 (17) | 0.14606 (7) | 0.0275 (3) | |
C1 | 0.11886 (17) | 0.7632 (2) | 0.01841 (9) | 0.0325 (4) | |
C2 | 0.1317 (2) | 0.6999 (3) | −0.04910 (10) | 0.0472 (5) | |
H2A | 0.0605 | 0.6741 | −0.0778 | 0.057* | |
C3 | 0.2471 (2) | 0.6765 (3) | −0.07224 (10) | 0.0508 (5) | |
H3A | 0.2552 | 0.6332 | −0.1165 | 0.061* | |
C4 | 0.35505 (19) | 0.7178 (3) | −0.02912 (9) | 0.0393 (4) | |
C5 | 0.4803 (2) | 0.6986 (3) | −0.04949 (11) | 0.0541 (6) | |
H5A | 0.4929 | 0.6540 | −0.0931 | 0.065* | |
C6 | 0.5804 (2) | 0.7435 (3) | −0.00711 (11) | 0.0537 (6) | |
H6A | 0.6609 | 0.7298 | −0.0217 | 0.064* | |
C7 | 0.56433 (17) | 0.8120 (3) | 0.05998 (10) | 0.0397 (4) | |
C8 | 0.66470 (19) | 0.8661 (3) | 0.10598 (12) | 0.0511 (5) | |
H8A | 0.7468 | 0.8577 | 0.0931 | 0.061* | |
C9 | 0.64241 (19) | 0.9302 (3) | 0.16884 (12) | 0.0478 (5) | |
H9A | 0.7091 | 0.9659 | 0.1992 | 0.057* | |
C10 | 0.51845 (17) | 0.9430 (2) | 0.18838 (9) | 0.0350 (4) | |
C11 | 0.44274 (15) | 0.8321 (2) | 0.08260 (8) | 0.0289 (3) | |
C12 | 0.33615 (16) | 0.7831 (2) | 0.03694 (8) | 0.0281 (3) | |
C13 | −0.00801 (18) | 0.7856 (3) | 0.04536 (10) | 0.0438 (4) | |
H13A | −0.0302 | 0.6831 | 0.0694 | 0.066* | |
H13B | −0.0691 | 0.8066 | 0.0073 | 0.066* | |
H13C | −0.0062 | 0.8816 | 0.0767 | 0.066* | |
C14 | 0.4920 (2) | 1.0068 (3) | 0.25888 (10) | 0.0537 (6) | |
H14A | 0.4243 | 1.0884 | 0.2547 | 0.081* | |
H14B | 0.5659 | 1.0614 | 0.2802 | 0.081* | |
H14C | 0.4691 | 0.9116 | 0.2870 | 0.081* | |
O1 | 0.18364 (13) | 0.98991 (18) | 0.24857 (6) | 0.0408 (3) | |
O2 | −0.02000 (15) | 1.0452 (3) | 0.22488 (8) | 0.0613 (4) | |
C15 | 0.0760 (2) | 1.0407 (3) | 0.26275 (10) | 0.0471 (5) | |
O3 | 0.18495 (13) | 1.12747 (15) | 0.10994 (6) | 0.0365 (3) | |
O4 | 0.18327 (18) | 1.41073 (16) | 0.10823 (8) | 0.0530 (4) | |
C16 | 0.19793 (18) | 1.2723 (2) | 0.13792 (9) | 0.0360 (4) | |
O5 | 0.19568 (12) | 0.67025 (15) | 0.19376 (6) | 0.0344 (3) | |
H5B | 0.1958 | 0.5834 | 0.1636 | 0.051* | |
H5C | 0.1416 | 0.6452 | 0.2242 | 0.054* | |
H15 | 0.0751 | 1.0904 | 0.3111 | 0.052* | |
H16 | 0.2383 | 1.2705 | 0.1852 | 0.049* |