Table 2. Selected Representative Bond Lengths and Angles of [H(NO3S)](PF6) and [Cu(NO3S)][Cu(NO3)4]a.
| [H(NO3S)](PF6) | |||
|---|---|---|---|
| Bond | Bond length [Å] | Angle | Degrees |
| N(8)–C(28) | 1.485(9) | C(28)–N(8)–C(17) | 111.8(5) |
| N(8)–C(17) | 1.507(9) | C(28)–N(8)–C(14) | 114.4(5) |
| N(8)–C(14) | 1.514(10) | C(17)–N(8)–C(14) | 112.5(6) |
| N(9)–C(22) | 1.471(8) | C(15)–S(11A)–C(16A) | 96.6(7) |
| N(10)–C(23) | 1.467(9) | C(16B)–S(11B)–C(15) | 97.0(9) |
| S(11A)–C(15) | 1.72(10) | C(20)–S(12)–C(21) | 100.4(3) |
| S(11A)–C(16A) | 1.82(2) | C(14)–C(15)–S(11A) | 122.6(7) |
| S(11B)–C(16B) | 1.82(2) | C(14)–C(15)–S(11B) | 102.6(7) |
| S(11B)–C(15) | 1.957(12) | C(19)–C(20)–S(12) | 112.4(4) |
| S(12)–C(20) | 1.799(6) | C(24)–C(25)–S(13) | 112.6(5) |
| S(12)–C(21) | 1.804(7) | ||
| [Cu(NO3S)][Cu(NO3)4] | |||
|---|---|---|---|
| Bond | Bond length [Å] | Angle | Degrees |
| Cu(1)–N(3) | 2.064(12) | N(3)–Cu(1)–N(1) | 84.1(5) |
| Cu(1)–N(2) | 2.153(12) | N(3)–Cu(1)–S(1) | 169.6(3) |
| Cu(1)–N(1) | 2.186(11) | N(3)–Cu(1)–S(2) | 85.0(3) |
| Cu(1)–S(1) | 2.383(4) | N(3)–Cu(1)–S(3) | 96.8(3) |
| Cu(1)–S(2) | 2.476(4) | S(1)–Cu(1)–S(3) | 93.2(2) |
| Cu(1)–S(3) | 2.727(5) | S(1)–Cu(1)–S(2) | 96.69(14) |
| S(1)–C(7) | 1.82(2) | S(1)–Cu(1)–S(3) | 93.2(2) |
| S(2)–C(13) | 1.80(2) | C(8)–S(1)–C(7) | 101.3(8) |
| S(3)–C(3) | 1.81(2) | C(8)–S(1)–Cu(1) | 110.6(6) |
| Cu(2)–O(101) | 1.950(11) | C(7)–S(1)–Cu(1) | 98.8(5) |
| Cu(2)–O(104) | 1.959(11) | C(7)–S(1)–Cu(1) | 98.8(5) |