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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
428966 |
135168551 |
2 |
NH21C34 |
AB21C34 |
307.24 |
1.48 |
-7.66 |
-0.55 |
0 |
|
|
428967 |
135168552 |
2 |
NH21C34 |
AB21C34 |
304.75 |
1.46 |
-7.73 |
-0.65 |
0 |
|
|
428968 |
135168553 |
2 |
NH22C34 |
AB22C34 |
303.63 |
1.46 |
-7.66 |
-0.56 |
0 |
|
|
428969 |
135168554 |
2 |
NH22C34 |
AB22C34 |
300.99 |
1.13 |
-7.73 |
-0.61 |
0 |
|
|
428970 |
135168555 |
2 |
NH22C36 |
AB22C36 |
322.82 |
2.69 |
-7.99 |
-0.72 |
0 |
|
|
428971 |
135168556 |
2 |
NH20C31 |
AB20C31 |
345.33 |
1.43 |
-7.76 |
-0.88 |
0 |
|
|
428972 |
135168557 |
2 |
NH21C33 |
AB21C33 |
295.89 |
1.84 |
-7.87 |
-0.66 |
0 |
|
|
428973 |
135168558 |
2 |
NH23C36 |
AB23C36 |
317.87 |
1.27 |
-7.71 |
-0.65 |
0 |
|
|
428974 |
135168559 |
2 |
NH23C37 |
AB23C37 |
327.57 |
1.9 |
-7.75 |
-0.68 |
0 |
|
|
428975 |
135168560 |
2 |
NH20C33 |
AB20C33 |
299.79 |
1.58 |
-7.88 |
-0.65 |
0 |
|
|
428976 |
135168561 |
1 |
N2H48C71 |
A2B48C71 |
290.28 |
2.39 |
-7.75 |
-0.68 |
0 |
|
|
428977 |
135168562 |
2 |
NH24C37 |
AB24C37 |
324.22 |
1.53 |
-7.73 |
-0.66 |
0 |
|
|
428978 |
135168563 |
1 |
ON2H44C74 |
AB2C44D74 |
306.64 |
0.8 |
-7.76 |
-0.6 |
0 |
|
|
428979 |
135168564 |
1 |
ON2H46C74 |
AB2C46D74 |
301.59 |
2.88 |
-7.97 |
-0.69 |
0 |
|
|
428980 |
135168565 |
2 |
NH21C34 |
AB21C34 |
307.41 |
1.6 |
-7.91 |
-0.62 |
0 |
|
|
428981 |
135168566 |
1 |
ON2H44C74 |
AB2C44D74 |
305.72 |
2.59 |
-7.84 |
-0.64 |
0 |
|
|
428982 |
135168567 |
2 |
NH22C34 |
AB22C34 |
302.78 |
1.8 |
-7.99 |
-0.66 |
0 |
|
|
428983 |
135168568 |
2 |
NH22C34 |
AB22C34 |
306.52 |
0.98 |
-7.73 |
-0.5 |
0 |
|
|
428984 |
135168569 |
2 |
NH19C31 |
AB19C31 |
284.16 |
0.78 |
-7.74 |
-0.57 |
0 |
|
|
428985 |
135168570 |
2 |
NH22C36 |
AB22C36 |
325.27 |
1.06 |
-7.69 |
-0.52 |
0 |
|
|
428986 |
135168580 |
2 |
NH24C37 |
AB24C37 |
326.31 |
1.15 |
-7.78 |
-0.6 |
0 |
|
|
428987 |
135168581 |
1 |
N2H48C71 |
A2B48C71 |
292.43 |
1.83 |
-7.83 |
-0.66 |
0 |
|
|
428988 |
135168582 |
1 |
N2H50C81 |
A2B50C81 |
360.41 |
0.69 |
-7.9 |
-0.6 |
0 |
|
|
428989 |
135168583 |
1 |
ON2H46C74 |
AB2C46D74 |
303.09 |
1.34 |
-7.96 |
-0.66 |
0 |
|
|
428990 |
135168584 |
1 |
N2H50C81 |
A2B50C81 |
363.31 |
1.13 |
-8.04 |
-0.55 |
0 |
|
|
428991 |
135168585 |
1 |
ON2H48C80 |
AB2C48D80 |
327.45 |
2.25 |
-7.87 |
-0.72 |
0 |
|
|
428992 |
135168586 |
1 |
ON2H48C80 |
AB2C48D80 |
326.39 |
1.54 |
-7.91 |
-0.63 |
0 |
|
|
428993 |
135168587 |
1 |
ON2H48C80 |
AB2C48D80 |
328.5 |
1.71 |
-7.96 |
-0.62 |
0 |
|
|
428994 |
135168591 |
2 |
NH23C37 |
AB23C37 |
330.22 |
1.36 |
-8.1 |
-0.69 |
0 |
|
|
428995 |
135168649 |
2 |
NH23C37 |
AB23C37 |
327.8 |
0.62 |
-8.02 |
-0.58 |
0 |
|
|
428996 |
135168650 |
1 |
N2H52C77 |
A2B52C77 |
314.1 |
1.18 |
-8.04 |
-0.5 |
0 |
|
|
428997 |
135168651 |
1 |
ON2H50C80 |
AB2C50D80 |
324.47 |
1.92 |
-7.94 |
-0.66 |
0 |
|
|
428998 |
135168652 |
1 |
ON2H50C80 |
AB2C50D80 |
326.03 |
2.96 |
-8.13 |
-0.69 |
0 |
|
|
428999 |
135168653 |
2 |
NH24C37 |
AB24C37 |
326.22 |
1.4 |
-8.03 |
-0.56 |
0 |
|
|
429000 |
135168654 |
2 |
NH26C40 |
AB26C40 |
348.28 |
0.79 |
-8.08 |
-0.62 |
0 |
|
|
429001 |
135168655 |
2 |
NH24C37 |
AB24C37 |
331.09 |
1.94 |
-8.09 |
-0.62 |
0 |
|
|
429002 |
135168656 |
1 |
ON2H50C80 |
AB2C50D80 |
323.04 |
0.13 |
-8.0 |
-0.68 |
0 |
|
|
429003 |
135168657 |
2 |
NH24C37 |
AB24C37 |
323.1 |
0.86 |
-7.99 |
-0.61 |
0 |
|
|
429004 |
135168658 |
2 |
NH24C37 |
AB24C37 |
325.53 |
1.11 |
-7.95 |
-0.48 |
0 |
|
|
429005 |
135168659 |
2 |
NH24C37 |
AB24C37 |
323.45 |
0.58 |
-7.94 |
-0.7 |
0 |
|
|
429006 |
135168660 |
2 |
NH25C39 |
AB25C39 |
347.83 |
1.2 |
-7.92 |
-0.63 |
0 |
|
|
429007 |
135168661 |
1 |
ClN2C15H23 |
AB2C15D23 |
-9.18 |
1.61 |
-8.67 |
0.06 |
0 |
|
|
429008 |
135168662 |
2 |
NC8H13 |
AB8C13 |
-2.93 |
0.61 |
-8.54 |
0.45 |
0 |
|
|
429009 |
135168663 |
2 |
NH23C36 |
AB23C36 |
317.84 |
0.82 |
-7.99 |
-0.56 |
0 |
|
|
429010 |
135168664 |
2 |
NH26C40 |
AB26C40 |
346.56 |
0.7 |
-8.09 |
-0.6 |
0 |
|
|
429011 |
135168665 |
1 |
N2H52C77 |
A2B52C77 |
312.0 |
1.02 |
-7.93 |
-0.61 |
0 |
|
|
429012 |
135168666 |
2 |
NH22C34 |
AB22C34 |
299.59 |
0.49 |
-7.94 |
-0.53 |
0 |
|
|
429013 |
135168667 |
1 |
ON2H50C84 |
AB2C50D84 |
341.34 |
0.35 |
-7.94 |
-0.73 |
0 |
|
|
429014 |
135168668 |
1 |
ON2H50C84 |
AB2C50D84 |
342.37 |
1.74 |
-7.89 |
-0.75 |
0 |
|
|
429015 |
135168669 |
1 |
ON2H50C84 |
AB2C50D84 |
343.08 |
1.79 |
-8.06 |
-0.61 |
0 |
|
|
429016 |
135168670 |
2 |
NH26C42 |
AB26C42 |
368.46 |
1.05 |
-7.9 |
-0.67 |
0 |
|
|
429017 |
135168671 |
2 |
NH24C39 |
AB24C39 |
345.03 |
2.24 |
-8.02 |
-0.78 |
0 |
|
|
429018 |
135168672 |
2 |
NH24C39 |
AB24C39 |
347.72 |
1.12 |
-8.06 |
-0.6 |
0 |
|
|
429019 |
135168673 |
2 |
NH24C39 |
AB24C39 |
345.02 |
0.93 |
-8.04 |
-0.5 |
0 |
|
|
429020 |
135168674 |
2 |
NH24C39 |
AB24C39 |
344.95 |
0.72 |
-7.89 |
-0.65 |
0 |
|
|
429021 |
135168675 |
2 |
NH24C39 |
AB24C39 |
342.59 |
0.78 |
-7.87 |
-0.64 |
0 |
|
|
429022 |
135168676 |
2 |
NH24C39 |
AB24C39 |
346.07 |
0.81 |
-7.94 |
-0.76 |
0 |
|
|
429023 |
135168677 |
2 |
NH22C36 |
AB22C36 |
321.88 |
0.88 |
-8.03 |
-0.5 |
0 |
|
|
429024 |
135168678 |
2 |
NH25C41 |
AB25C41 |
359.97 |
1.45 |
-7.88 |
-0.75 |
0 |
|
|
429025 |
135168679 |
2 |
NH22C36 |
AB22C36 |
320.67 |
0.79 |
-7.95 |
-0.54 |
0 |
|
|
429026 |
135168680 |
2 |
NH25C41 |
AB25C41 |
361.64 |
1.63 |
-8.04 |
-0.64 |
0 |
|
|
429027 |
135168681 |
2 |
NH23C38 |
AB23C38 |
341.38 |
1.96 |
-7.92 |
-0.7 |
0 |
|
|
429028 |
135168682 |
2 |
NH23C38 |
AB23C38 |
338.26 |
1.56 |
-7.97 |
-0.75 |
0 |
|
|
429029 |
135168683 |
2 |
NH26C42 |
AB26C42 |
368.05 |
2.41 |
-8.03 |
-0.8 |
0 |
|
|
429030 |
135168684 |
1 |
N2H52C81 |
A2B52C81 |
333.6 |
1.49 |
-7.92 |
-0.7 |
0 |
|
|
429031 |
135168685 |
2 |
NH26C42 |
AB26C42 |
369.01 |
1.45 |
-8.1 |
-0.86 |
0 |
|
|
429032 |
135168686 |
1 |
N2H52C81 |
A2B52C81 |
331.39 |
1.18 |
-7.86 |
-0.72 |
0 |
|
|
429033 |
135168687 |
1 |
ON2H50C84 |
AB2C50D84 |
343.79 |
1.49 |
-8.03 |
-0.68 |
0 |
|
|
429034 |
135168688 |
1 |
ON2H52C84 |
AB2C52D84 |
340.53 |
1.52 |
-8.03 |
-0.69 |
0 |
|
|
429035 |
135168689 |
1 |
ON2H52C84 |
AB2C52D84 |
340.28 |
0.79 |
-8.06 |
-0.62 |
0 |
|
|
429036 |
135168690 |
2 |
NH25C39 |
AB25C39 |
340.28 |
1.47 |
-7.95 |
-0.84 |
0 |
|
|
429037 |
135168691 |
2 |
NH25C39 |
AB25C39 |
341.72 |
1.18 |
-8.07 |
-0.71 |
0 |
|
|
429038 |
135168692 |
2 |
NH25C39 |
AB25C39 |
342.18 |
1.39 |
-8.01 |
-0.76 |
0 |
|
|
429039 |
135168693 |
2 |
NH25C39 |
AB25C39 |
344.54 |
1.23 |
-8.06 |
-0.58 |
0 |
|
|
429040 |
135168703 |
1 |
N2H54C81 |
A2B54C81 |
328.37 |
0.97 |
-7.85 |
-0.69 |
0 |
|
|
429041 |
135168704 |
2 |
NH27C42 |
AB27C42 |
363.26 |
1.49 |
-8.02 |
-0.81 |
0 |
|
|
429042 |
135168705 |
1 |
N2H54C81 |
A2B54C81 |
330.75 |
2.14 |
-7.93 |
-0.61 |
0 |
|
|
429043 |
135168706 |
1 |
ON2H48C80 |
AB2C48D80 |
327.07 |
2.12 |
-7.92 |
-0.73 |
0 |
|
|
429044 |
135168707 |
1 |
ON2H52C84 |
AB2C52D84 |
339.99 |
1.88 |
-7.79 |
-0.85 |
0 |
|
|
429045 |
135168708 |
1 |
ON2H48C80 |
AB2C48D80 |
418.41 |
1.8 |
-8.0 |
-0.9 |
0 |
|
|
429046 |
135168709 |
1 |
ON2H52C84 |
AB2C52D84 |
339.33 |
1.38 |
-7.86 |
-0.89 |
0 |
|
|
429047 |
135168710 |
2 |
NH23C37 |
AB23C37 |
327.05 |
0.98 |
-7.96 |
-0.52 |
0 |
|
|
429048 |
135168711 |
2 |
NH25C40 |
AB25C40 |
352.91 |
1.21 |
-7.94 |
-0.54 |
0 |
|
|
429049 |
135168714 |
2 |
NH23C37 |
AB23C37 |
329.1 |
1.31 |
-8.04 |
-0.55 |
0 |
|
|
429050 |
135168717 |
2 |
NH24C39 |
AB24C39 |
495.84 |
7.33 |
-7.01 |
-1.88 |
0 |
|
|
429051 |
135168720 |
2 |
NH25C40 |
AB25C40 |
352.57 |
1.32 |
-8.06 |
-0.52 |
0 |
|
|
429052 |
135168721 |
2 |
NH25C40 |
AB25C40 |
350.8 |
1.16 |
-8.01 |
-0.58 |
0 |
|
|
429053 |
135168774 |
1 |
ON2H48C74 |
AB2C48D74 |
349.6 |
12.66 |
-6.76 |
-1.94 |
0 |
|
|
429054 |
135168775 |
1 |
ON2H48C74 |
AB2C48D74 |
297.19 |
2.04 |
-8.04 |
-0.65 |
0 |
|
|
429055 |
135168776 |
2 |
NH23C34 |
AB23C34 |
389.34 |
6.78 |
-6.53 |
-1.78 |
0 |
|
|
429056 |
135168777 |
2 |
NH23C34 |
AB23C34 |
301.85 |
2.37 |
-7.94 |
-0.46 |
0 |
|
|
429057 |
135168778 |
2 |
NH23C34 |
AB23C34 |
403.79 |
2.0 |
-8.28 |
-0.55 |
0 |
|
|
429058 |
135168779 |
2 |
NH23C34 |
AB23C34 |
299.65 |
2.29 |
-8.04 |
-0.5 |
0 |
|
|
429059 |
135168780 |
2 |
NH21C31 |
AB21C31 |
275.92 |
3.36 |
-7.98 |
-0.4 |
0 |
|
|
429060 |
135168781 |
2 |
NH23C34 |
AB23C34 |
303.65 |
0.94 |
-8.11 |
-0.45 |
0 |
|
|
429061 |
135168782 |
2 |
NH22C33 |
AB22C33 |
293.05 |
3.44 |
-7.93 |
-0.61 |
0 |
|
|
429062 |
135168783 |
2 |
NH24C36 |
AB24C36 |
316.44 |
2.05 |
-8.08 |
-0.47 |
0 |
|
|
429063 |
135168784 |
2 |
NH21C31 |
AB21C31 |
328.72 |
10.99 |
-6.72 |
-1.91 |
0 |
|
|
429064 |
135168785 |
2 |
NH23C34 |
AB23C34 |
300.21 |
2.41 |
-8.02 |
-0.52 |
0 |
|
|
429065 |
135168786 |
1 |
N2H50C71 |
A2B50C71 |
288.33 |
2.49 |
-8.01 |
-0.47 |
0 |