Structure Determination of Complexes involving Pd and Cu

목차

tructure Determination of Complexes involving
Pd and Cu


1. Abstract

2. Introduction

3. Experiment
　3.1 apparatus
　3.2 Method

4. Results
　4.1. Cu Complex 화합물의 X-ray 단결정 구조
　4.2. Pd Complex 화합물의 X-ray 단결정 구조

본문내용

C(16) 126.5(6)
C(18)-C(17)-H(17) 116.7
C(16)-C(17)-H(17) 116.7
O(22)-C(18)-C(17) 127.1(6)
O(22)-C(18)-C(23) 113.8(6)
C(17)-C(18)-C(23) 119.0(6)
N(15)-C(19)-H(19A) 109.5
N(15)-C(19)-H(19B) 109.5
H(19A)-C(19)-H(19B) 109.5
N(15)-C(19)-H(19C) 109.5
H(19A)-C(19)-H(19C) 109.5
H(19B)-C(19)-H(19C) 109.5
N(15)-C(20)-H(20A) 109.5
N(15)-C(20)-H(20B) 109.5
H(20A)-C(20)-H(20B) 109.5
N(15)-C(20)-H(20C) 109.5
H(20A)-C(20)-H(20C) 109.5
H(20B)-C(20)-H(20C) 109.5
C(16)-O(21)-Pd 125.2(4)
C(18)-O(22)-Pd 123.2(4)
C(24)-C(23)-C(28) 117.1(7)
C(24)-C(23)-C(18) 123.7(7)
C(28)-C(23)-C(18) 119.2(7)
C(25)-C(24)-C(23) 123.2(8)
C(25)-C(24)-H(24) 118.4
C(23)-C(24)-H(24) 118.4
C(24)-C(25)-C(26) 119.0(8)
C(24)-C(25)-H(25) 120.5
C(26)-C(25)-H(25) 120.5
C(27)-C(26)-C(25) 119.7(8)
C(27)-C(26)-H(26) 120.2
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C(25)-C(26)-H(26) 120.2
C(26)-C(27)-C(28) 120.8(9)
C(26)-C(27)-H(27) 119.6
C(28)-C(27)-H(27) 119.6
C(27)-C(28)-C(23) 120.2(8)
C(27)-C(28)-H(28) 119.9
C(23)-C(28)-H(28) 119.9
Cl(1)#1-C(29)-Cl(1) 127.58(13)
Cl(1)#1-C(29)-H(29A) 105.4
Cl(1)-C(29)-H(29A) 105.4
Cl(1)#1-C(29)-H(29B) 105.4
Cl(1)-C(29)-H(29B) 105.4
H(29A)-C(29)-H(29B) 106.0
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Symmetry transformations used to generate equivalent atoms:
#1 -x+1,y,-z+1/2
Table 8. Anisotropic displacement parameters (A^2 x 10^3) for pdketoam.
The anisotropic displacement factor exponent takes the form:
-2 pi^2 [ h^2 a*^2 U11 + ... + 2 h k a* b* U12 ]
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U11 U22 U33 U23 U13 U12
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Pd 45(1) 53(1) 49(1) -1(1) -4(1) 0(1)
N(1) 47(3) 65(4) 67(4) 0(3) -4(3) -4(3)
C(2) 48(4) 51(4) 61(4) 2(3) -2(3) -1(3)
C(3) 47(4) 63(5) 61(4) 4(4) -4(3) -6(4)
C(4) 54(4) 52(4) 49(4) 4(3) -7(3) 3(3)
C(5) 50(4) 71(5) 89(6) 3(5) -2(4) -2(4)
C(6) 64(5) 100(7) 81(6) 7(5) 22(5) -7(5)
O(7) 51(3) 78(4) 55(3) -2(3) -2(2) -3(3)
O(8) 49(3) 82(4) 51(3) -10(3) -2(2) -2(3)
C(9) 56(4) 71(5) 44(4) -1(3) -8(3) 10(4)
C(10) 83(6) 94(7) 69(6) 3(5) 2(5) 3(5)
C(11) 89(7) 159(12) 62(6) -7(6) 13(5) 8(7)
C(12) 113(9) 207(15) 50(5) -24(8) -22(6) 41(10)
C(13) 96(8) 171(12) 64(6) -42(7) -20(6) 1(8)
C(14) 82(6) 97(7) 61(5) -5(5) -16(4) 2(5)
N(15) 56(3) 57(4) 54(3) -9(3) -4(3) 8(3)
C(16) 45(4) 43(4) 50(4) 4(3) -4(3) -2(3)
C(17) 48(4) 53(4) 49(4) 1(3) -8(3) 2(3)
C(18) 45(4) 41(3) 60(4) 3(3) -7(3) -4(3)
C(19) 62(5) 76(5) 57(4) -8(4) -13(4) 4(4)
C(20) 66(5) 76(5) 56(4) -16(4) 5(4) 1(4)
O(21) 46(3) 68(3) 56(3) -4(3) -2(2) 0(2)
O(22) 51(3) 69(3) 50(3) -6(2) 0(2) 1(2)
C(23) 54(4) 48(4) 56(4) -11(3) 3(3) 2(3)
C(24) 58(5) 78(6) 61(5) 1(4) 5(4) -2(4)
C(25) 54(5) 128(8) 73(6) -17(6) -2(4) -5(5)
C(26) 50(5) 142(10) 98(7) -20(7) 10(5) -16(6)
C(27) 84(6) 111(8) 70(5) 5(5) 25(5) -9(6)
C(28) 61(5) 83(6) 69(5) 2(4) 5(4) 3(4)
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키워드

pd,   cu,   x-ray,   diffraction,   x-ray diffraction