Table II.
Interactions | H···A/ Å | D···A/ Å | ∠D–H···A/º | Symmetry code |
---|---|---|---|---|
Form I | ||||
O(1)─H(1)···O(8) | 2.14 | 2.862 | 146 | −1 + x,y,z |
O(2)─H(2A)···O(6) | 2.00 | 2.816 | 170 | 1−x,−1/2 + y,−z |
O(4)─H(4)···O(3) | 2.18 | 2.615 | 113 | Intramolecular |
O(4)─H(4)···O(10) | 2.32 | 3.093 | 158 | −x,−1/2 + y,−z |
O(5)─H(5A)···O(11) | 1.99 | 2.808 | 172 | 1−x,1/2 + y,1−z |
C(2)─H(2)···O(10) | 2.31 | 2.739 | 106 | Intramolecular |
C(3)─H(3)···O(8) | 2.53 | 3.093 | 116 | Intramolecular |
C(5)─H(5)···O(10) | 2.49 | 3.441 | 163 | 1 + x,y,z |
C(14)─H(14B)···O(9) | 2.44 | 2.882 | 107 | Intramolecular |
C(16)─H(16B)···O(4) | 2.55 | 3.161 | 122 | Intramolecular |
C(16)─H(16C)···O(3) | 2.51 | 3.082 | 119 | Intramolecular |
C(17)─H(17C)···O(1) | 2.56 | 2.918 | 102 | Intramolecular |
C(19)─H(19A)···O(6) | 2.45 | 3.312 | 149 | Intramolecular |
C(26)─H(26)···O(5) | 2.52 | 3.266 | 137 | 1−x,1/2 + y,1−z |
C(29)─H(29)···O(3) | 2.56 | 3.198 | 126 | −x,1/2 + y,−z |
Form II | ||||
O(1)─H(1)···O(8) | 2.15 | 2.892 | 150 | x,−1 + y,z |
O(2)─H(2)···O(11) | 1.83 | 2.627 | 165 | – |
O(4)─H(4)···O(3) | 2.07 | 2.571 | 119 | Intramolecular |
O(5)─H(5)···O(2) | 1.98 | 2.800 | 173 | x,y,1 + z |
C(2)─H(2A)···O(10) | 2.24 | 2.694 | 107 | Intramolecular |
C(3)─H(3)···O(8) | 2.50 | 3.076 | 117 | Intramolecular |
C(5)─H(5A)···O(10) | 2.43 | 3.368 | 160 | x,1 + y,z |
C(14)─H(14A)···O(9) | 2.54 | 2.945 | 105 | Intramolecular |
C(17)─H(17A)···O(3) | 2.58 | 3.196 | 122 | Intramolecular |
C(17)─H(17C)···O(4) | 2.56 | 3.135 | 119 | Intramolecular |
C(19)─H(19B)···O(6) | 2.43 | 3.287 | 148 | Intramolecular |
C(31)─H(31C)···O(3) | 2.58 | 3.454 | 151 | x,1 + y,z |