Crystal-structure studies of 4-phenyl­piperazin-1-ium 4-eth­oxy­benzoate monohydrate, 4-phenyl­piperazin-1-ium 4-meth­oxy­benzoate monohydrate, 4-phenyl­piperazin-1-ium 4-methyl­benzoate monohydrate and 4-phenyl­piperazin-1-ium tri­fluoro­acetate 0.12-hydrate

. 2022 Jun 10;78(Pt 7):709–715. doi: 10.1107/S2056989022006004

	U¹¹	U²²	U³³	U¹²	U¹³	U²³
C1	0.065 (2)	0.0490 (15)	0.0531 (16)	−0.0184 (13)	0.0022 (14)	−0.0040 (12)
C2	0.075 (2)	0.069 (2)	0.068 (2)	−0.0195 (16)	0.0111 (17)	−0.0051 (15)
C3	0.116 (3)	0.074 (2)	0.075 (2)	−0.025 (2)	0.033 (2)	−0.0120 (18)
C4	0.141 (4)	0.079 (2)	0.056 (2)	−0.028 (2)	−0.001 (2)	−0.0089 (17)
C5	0.107 (3)	0.098 (3)	0.072 (2)	−0.025 (2)	−0.026 (2)	−0.0087 (19)
C6	0.064 (2)	0.089 (2)	0.066 (2)	−0.0204 (17)	−0.0069 (16)	−0.0074 (16)
C7	0.073 (2)	0.086 (2)	0.0618 (18)	−0.0228 (17)	0.0105 (16)	−0.0132 (16)
C8	0.122 (3)	0.098 (3)	0.062 (2)	−0.039 (2)	0.010 (2)	−0.0215 (19)
C9	0.099 (3)	0.139 (4)	0.079 (3)	−0.044 (3)	−0.030 (2)	0.017 (2)
C10	0.065 (2)	0.128 (3)	0.063 (2)	−0.010 (2)	−0.0084 (17)	0.0067 (19)
C11	0.0597 (18)	0.0649 (18)	0.0512 (15)	−0.0254 (14)	0.0087 (13)	−0.0168 (13)
C12	0.086 (2)	0.0636 (18)	0.0605 (17)	−0.0280 (16)	0.0031 (15)	−0.0183 (14)
C13	0.089 (2)	0.093 (2)	0.066 (2)	−0.0390 (19)	0.0122 (18)	−0.0374 (19)
C14	0.076 (2)	0.119 (3)	0.0513 (17)	−0.044 (2)	0.0031 (16)	−0.019 (2)
C15	0.092 (3)	0.093 (3)	0.063 (2)	−0.024 (2)	−0.0075 (18)	−0.0006 (18)
C16	0.091 (2)	0.065 (2)	0.066 (2)	−0.0172 (16)	0.0037 (17)	−0.0140 (15)
C17	0.167 (4)	0.071 (2)	0.064 (2)	−0.042 (2)	0.028 (2)	−0.0283 (17)
C18	0.221 (6)	0.115 (4)	0.074 (3)	−0.078 (4)	0.039 (3)	−0.050 (2)
C19	0.118 (3)	0.118 (3)	0.0538 (19)	−0.051 (2)	0.0026 (19)	−0.0131 (19)
C20	0.094 (3)	0.076 (2)	0.0602 (18)	−0.0257 (18)	−0.0026 (17)	−0.0121 (16)
C21	0.102 (3)	0.086 (2)	0.0458 (17)	−0.0309 (19)	−0.0063 (17)	−0.0135 (16)
C22	0.194 (6)	0.122 (4)	0.068 (3)	−0.074 (4)	−0.044 (3)	0.011 (3)
C22'	0.194 (6)	0.122 (4)	0.068 (3)	−0.074 (4)	−0.044 (3)	0.011 (3)
C23	0.159 (4)	0.066 (2)	0.052 (2)	−0.032 (2)	0.011 (3)	−0.0113 (16)
C24	0.172 (5)	0.084 (3)	0.070 (2)	−0.047 (3)	0.028 (3)	−0.028 (2)
C24'	0.172 (5)	0.084 (3)	0.070 (2)	−0.047 (3)	0.028 (3)	−0.028 (2)
N1	0.0591 (15)	0.0674 (15)	0.0519 (13)	−0.0234 (12)	−0.0030 (11)	−0.0028 (11)
N2	0.136 (3)	0.082 (2)	0.0530 (15)	−0.0447 (19)	−0.0139 (17)	−0.0015 (13)
N3	0.094 (2)	0.0709 (16)	0.0501 (13)	−0.0357 (14)	0.0087 (12)	−0.0184 (12)
N4	0.162 (3)	0.127 (3)	0.0538 (16)	−0.066 (2)	0.0207 (19)	−0.0303 (18)
O1	0.205 (3)	0.0908 (18)	0.0635 (16)	−0.0618 (19)	0.0128 (17)	−0.0133 (13)
O2	0.163 (3)	0.164 (3)	0.0675 (16)	−0.038 (2)	0.0098 (17)	−0.0474 (18)
O3	0.161 (3)	0.157 (3)	0.0719 (18)	−0.062 (3)	0.0133 (19)	−0.0395 (18)
O4	0.154 (3)	0.121 (2)	0.0633 (15)	−0.0477 (19)	0.0290 (17)	−0.0313 (14)
F1	0.249 (6)	0.248 (6)	0.198 (6)	−0.196 (5)	−0.015 (4)	−0.040 (4)
F2	0.289 (8)	0.078 (3)	0.159 (4)	−0.016 (4)	0.037 (5)	−0.053 (2)
F3	0.278 (7)	0.117 (3)	0.142 (4)	−0.095 (3)	−0.104 (5)	0.068 (3)
F1'	0.249 (6)	0.248 (6)	0.198 (6)	−0.196 (5)	−0.015 (4)	−0.040 (4)
F2'	0.289 (8)	0.078 (3)	0.159 (4)	−0.016 (4)	0.037 (5)	−0.053 (2)
F3'	0.278 (7)	0.117 (3)	0.142 (4)	−0.095 (3)	−0.104 (5)	0.068 (3)
F4	0.227 (5)	0.149 (4)	0.137 (4)	−0.024 (4)	0.046 (3)	−0.082 (4)
F5	0.411 (11)	0.084 (2)	0.0504 (17)	−0.087 (4)	−0.014 (3)	0.0007 (16)
F6	0.226 (5)	0.152 (4)	0.118 (3)	−0.092 (4)	0.009 (3)	−0.061 (3)
F4'	0.227 (5)	0.149 (4)	0.137 (4)	−0.024 (4)	0.046 (3)	−0.082 (4)
F5'	0.411 (11)	0.084 (2)	0.0504 (17)	−0.087 (4)	−0.014 (3)	0.0007 (16)
F6'	0.226 (5)	0.152 (4)	0.118 (3)	−0.092 (4)	0.009 (3)	−0.061 (3)
OW1	0.082 (10)	0.146 (13)	0.219 (18)	−0.019 (8)	−0.031 (9)	−0.048 (11)