104981 -OEChem-04192416282D 67 68 0 0 0 0 0 0 0999 V2000 5.0806 2.5306 0.0000 I 0 5 0 0 0 0 0 0 0 0 0 0 5.0806 0.0000 0.0000 I 0 5 0 0 0 0 0 0 0 0 0 0 8.3984 9.1812 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 4.9343 9.1812 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 6.7202 12.2263 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5381 8.6571 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5324 8.6812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2644 9.6812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8984 8.3152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6663 9.1812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8984 10.0472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8003 8.6812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1304 9.1812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3984 7.4492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0682 8.6812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9343 10.1812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2022 9.1812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0682 10.6812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2022 10.1812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0682 7.6812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8443 10.6881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0522 11.7227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3083 8.6466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3083 10.7159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8523 11.7297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9502 12.2505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4022 9.1604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4022 10.2020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9343 7.1812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2022 7.1812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9343 6.1812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2022 6.1812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0682 5.6812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1338 8.2063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9309 8.2063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6629 10.1562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8659 10.1562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3733 7.9167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3733 8.7137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0649 9.6562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2678 9.6562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4353 10.3572 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5884 10.5842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3614 9.7372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4018 8.2063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1988 8.2063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8204 8.6443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6674 8.8712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4404 9.7182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8614 7.7592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0884 6.9122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9353 7.1392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3776 10.3719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5117 12.0265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3155 8.0266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3155 11.3358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9478 12.8705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8665 10.5141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4712 7.4912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6653 7.4912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4712 5.8712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6653 5.8712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7226 12.8463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2560 11.9143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0682 5.0612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 8.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5405 8.0371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3 7 1 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 3 11 1 0 0 0 0 4 12 1 0 0 0 0 4 15 1 0 0 0 0 4 16 2 0 0 0 0 5 25 1 0 0 0 0 5 63 1 0 0 0 0 5 64 1 0 0 0 0 6 27 1 0 0 0 0 6 66 1 0 0 0 0 6 67 1 0 0 0 0 7 10 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 13 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 14 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 12 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 11 44 1 0 0 0 0 12 45 1 0 0 0 0 12 46 1 0 0 0 0 13 47 1 0 0 0 0 13 48 1 0 0 0 0 13 49 1 0 0 0 0 14 50 1 0 0 0 0 14 51 1 0 0 0 0 14 52 1 0 0 0 0 15 17 2 0 0 0 0 15 20 1 0 0 0 0 16 18 1 0 0 0 0 16 21 1 0 0 0 0 17 19 1 0 0 0 0 17 23 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 24 1 0 0 0 0 20 29 2 0 0 0 0 20 30 1 0 0 0 0 21 25 2 0 0 0 0 21 53 1 0 0 0 0 22 26 2 0 0 0 0 22 54 1 0 0 0 0 23 27 2 0 0 0 0 23 55 1 0 0 0 0 24 28 2 0 0 0 0 24 56 1 0 0 0 0 25 26 1 0 0 0 0 26 57 1 0 0 0 0 27 28 1 0 0 0 0 28 58 1 0 0 0 0 29 31 1 0 0 0 0 29 59 1 0 0 0 0 30 32 2 0 0 0 0 30 60 1 0 0 0 0 31 33 2 0 0 0 0 31 61 1 0 0 0 0 32 33 1 0 0 0 0 32 62 1 0 0 0 0 33 65 1 0 0 0 0 M CHG 4 1 -1 2 -1 3 1 4 1 M END > 104981 > 1 > 555 > 4 > 2 > 7 > AAADcfB7gAAAAwAAAAAAAAAAAAAAAAAAAAA8YMEAAAAAAACx/AAAHAAQAAAADAjBHgQywPNMEACgAyRiRACCgCAhAiAI2CA4ZJgIIOLA0dGEJAhgkADIyAcQgMAOiAAAQAQSAAAQAACACCQAAAAAAAAAAA== > 3-(3,8-diamino-6-phenyl-phenanthridin-5-ium-5-yl)propyl-diethyl-methyl-ammonium;diiodide > 3-(3,8-diamino-6-phenyl-5-phenanthridin-5-iumyl)propyl-diethyl-methylammonium;diiodide > 3-(3,8-diamino-6-phenylphenanthridin-5-ium-5-yl)propyl-diethyl-methylazanium;diiodide > 3-(3,8-diamino-6-phenylphenanthridin-5-ium-5-yl)propyl-diethyl-methylazanium;diiodide > 3-[3,8-bis(azanyl)-6-phenyl-phenanthridin-5-ium-5-yl]propyl-diethyl-methyl-azanium;diiodide > 3-(3,8-diamino-6-phenyl-phenanthridin-5-ium-5-yl)propyl-diethyl-methyl-ammonium;diiodide > InChI=1S/C27H33N4.2HI/c1-4-31(3,5-2)17-9-16-30-26-19-22(29)13-15-24(26)23-14-12-21(28)18-25(23)27(30)20-10-7-6-8-11-20;;/h6-8,10-15,18-19,29H,4-5,9,16-17,28H2,1-3H3;2*1H/q+1;;/p-1 > XJMOSONTPMZWPB-UHFFFAOYSA-M > 668.08729 > C27H34I2N4 > 668.4 > CC[N+](C)(CC)CCC[N+]1=C2C=C(C=CC2=C3C=CC(=CC3=C1C4=CC=CC=C4)N)N.[I-].[I-] > CC[N+](C)(CC)CCC[N+]1=C2C=C(C=CC2=C3C=CC(=CC3=C1C4=CC=CC=C4)N)N.[I-].[I-] > 55.9 > 668.08729 > 0 > 33 > 0 > 0 > 0 > 0 > 0 > 3 > -1 > 1 5 255 > 15 17 8 16 18 8 16 21 8 17 19 8 17 23 8 18 19 8 18 22 8 19 24 8 20 29 8 20 30 8 21 25 8 22 26 8 23 27 8 24 28 8 25 26 8 27 28 8 29 31 8 30 32 8 31 33 8 32 33 8 4 15 8 4 16 8 $$$$