Isostructural rubidium and caesium 4-(3,5-di­nitro­pyrazol-4-yl)-3,5-di­nitro­pyrazolates: crystal engineering with polynitro energetic species

. 2021 Oct 13;77(Pt 11):1109–1115. doi: 10.1107/S2056989021010227

	U¹¹	U²²	U³³	U¹²	U¹³	U²³
Rb1	0.01707 (13)	0.01962 (14)	0.0442 (2)	0.000	0.00897 (13)	0.000
Rb2	0.02226 (15)	0.03355 (17)	0.0307 (2)	0.00090 (12)	0.00132 (12)	−0.01165 (14)
O1	0.0311 (8)	0.0188 (8)	0.0702 (14)	0.0128 (6)	0.0153 (9)	0.0038 (8)
O2	0.0284 (8)	0.0279 (8)	0.0533 (12)	−0.0005 (6)	0.0234 (8)	0.0034 (8)
O3	0.0212 (8)	0.0283 (9)	0.0941 (17)	−0.0011 (7)	0.0214 (9)	0.0036 (9)
O4	0.0411 (9)	0.0214 (8)	0.0519 (12)	0.0071 (7)	0.0299 (9)	−0.0003 (7)
O5	0.0206 (7)	0.0336 (8)	0.0327 (10)	−0.0044 (6)	0.0001 (7)	0.0048 (7)
O6	0.0375 (8)	0.0155 (7)	0.0272 (10)	−0.0001 (6)	0.0040 (7)	0.0046 (6)
O7	0.0313 (8)	0.0190 (7)	0.0470 (12)	0.0121 (6)	0.0111 (8)	0.0127 (7)
O8	0.0225 (7)	0.0231 (8)	0.0305 (10)	−0.0046 (6)	0.0037 (6)	0.0008 (7)
N1	0.0231 (8)	0.0089 (7)	0.0267 (11)	0.0004 (6)	0.0098 (7)	−0.0010 (7)
N2	0.0222 (8)	0.0127 (8)	0.0283 (11)	−0.0004 (6)	0.0109 (7)	0.0020 (7)
N3	0.0220 (8)	0.0141 (8)	0.0230 (10)	−0.0016 (6)	0.0067 (7)	−0.0010 (7)
N4	0.0213 (8)	0.0103 (7)	0.0277 (11)	−0.0001 (6)	0.0098 (7)	0.0009 (7)
N5	0.0211 (8)	0.0164 (8)	0.0230 (10)	0.0031 (6)	0.0064 (7)	−0.0051 (7)
N6	0.0256 (9)	0.0174 (9)	0.0423 (13)	0.0030 (7)	0.0198 (8)	0.0077 (8)
N7	0.0241 (9)	0.0176 (9)	0.0196 (10)	0.0010 (6)	0.0053 (7)	−0.0014 (7)
N8	0.0187 (8)	0.0180 (8)	0.0263 (11)	0.0031 (6)	0.0108 (7)	0.0057 (7)
C1	0.0203 (9)	0.0115 (9)	0.0193 (12)	0.0001 (7)	0.0070 (8)	0.0000 (7)
C2	0.0187 (9)	0.0104 (8)	0.0188 (11)	0.0010 (7)	0.0075 (8)	0.0008 (8)
C3	0.0203 (9)	0.0122 (9)	0.0223 (12)	0.0008 (7)	0.0095 (8)	0.0019 (8)
C4	0.0206 (9)	0.0119 (8)	0.0192 (11)	0.0007 (7)	0.0070 (8)	−0.0003 (7)
C5	0.0177 (9)	0.0109 (8)	0.0202 (12)	0.0014 (7)	0.0094 (8)	0.0003 (7)
C6	0.0185 (9)	0.0126 (8)	0.0198 (11)	0.0016 (7)	0.0089 (8)	0.0011 (7)