List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
287600 |
104248290 |
1 |
N2O5C12H14 |
A2B5C12D14 |
-111.27 |
4.97 |
-9.03 |
-1.5 |
0 |
|
|
287601 |
104248314 |
1 |
N2O5C13H18 |
A2B5C13D18 |
-123.77 |
5.59 |
-9.06 |
-1.49 |
0 |
|
|
287602 |
104248343 |
1 |
N2O4C15H22 |
A2B4C15D22 |
-102.98 |
7.04 |
-9.09 |
-1.53 |
0 |
|
|
287603 |
104248360 |
1 |
N3O4C10H13 |
A3B4C10D13 |
-52.96 |
6.62 |
-9.12 |
-1.51 |
0 |
|
|
287604 |
104248458 |
2 |
ON2C6H11 |
AB2C6D11 |
-30.48 |
2.15 |
-8.96 |
-0.35 |
0 |
|
|
287605 |
104248485 |
1 |
N3O3C14H17 |
A3B3C14D17 |
-32.45 |
2.17 |
-8.62 |
-0.74 |
0 |
|
|
287606 |
104248549 |
1 |
O2N3C12H21 |
A2B3C12D21 |
-50.25 |
2.76 |
-9.2 |
-0.27 |
0 |
|
|
287607 |
104248594 |
1 |
N3O3C9H17 |
A3B3C9D17 |
-72.12 |
4.71 |
-9.93 |
-0.43 |
0 |
|
|
287608 |
104248639 |
1 |
O2N3C15H21 |
A2B3C15D21 |
-16.7 |
1.4 |
-8.75 |
-0.42 |
0 |
|
|
287609 |
104248688 |
1 |
O2N3C11H21 |
A2B3C11D21 |
-48.13 |
3.68 |
-9.2 |
-0.26 |
0 |
|
|
287610 |
104248743 |
1 |
O2N3C14H25 |
A2B3C14D25 |
-66.32 |
4.4 |
-9.5 |
-0.3 |
0 |
|
|
287611 |
104248828 |
1 |
O2N3C14H23 |
A2B3C14D23 |
-51.17 |
1.98 |
-9.48 |
-0.27 |
0 |
|
|
287612 |
104248834 |
1 |
O2N3C16H27 |
A2B3C16D27 |
-61.3 |
3.23 |
-9.17 |
-0.25 |
0 |
|
|
287613 |
104248848 |
1 |
O2N3C14H17 |
A2B3C14D17 |
-15.05 |
2.84 |
-8.71 |
-0.73 |
0 |
|
|
287614 |
104248874 |
1 |
O2N3C13H23 |
A2B3C13D23 |
-57.54 |
2.9 |
-9.59 |
-0.26 |
0 |
|
|
287615 |
104248895 |
1 |
O2N3C15H25 |
A2B3C15D25 |
-54.36 |
2.6 |
-9.16 |
-0.16 |
0 |
|
|
287616 |
104248941 |
1 |
O2N3C13H23 |
A2B3C13D23 |
-56.99 |
3.23 |
-9.54 |
-0.14 |
0 |
|
|
287617 |
104248944 |
1 |
SO2N4C12H16 |
AB2C4D12E16 |
-2.93 |
4.82 |
-9.03 |
-0.46 |
0 |
|
|
287618 |
104248951 |
1 |
O2N3C15H25 |
A2B3C15D25 |
-60.35 |
1.03 |
-9.88 |
-0.39 |
0 |
|
|
287619 |
104248966 |
1 |
O2N3C16H29 |
A2B3C16D29 |
-70.69 |
3.71 |
-9.53 |
-0.24 |
0 |
|
|
287620 |
104248971 |
1 |
O2F3N3C11H16 |
A2B3C3D11E16 |
-197.57 |
2.85 |
-9.99 |
-0.84 |
0 |
|
|
287621 |
104248974 |
1 |
O2N3C12H21 |
A2B3C12D21 |
-52.56 |
4.11 |
-9.64 |
-0.16 |
0 |
|
|
287622 |
104249031 |
1 |
N2O4C13H18 |
A2B4C13D18 |
-99.77 |
1.22 |
-9.9 |
-0.57 |
0 |
|
|
287623 |
104249102 |
2 |
NOC6H10 |
ABC6D10 |
-92.88 |
9.69 |
-9.3 |
0.21 |
0 |
|
|
287624 |
104249130 |
1 |
N2O3C11H18 |
A2B3C11D18 |
-134.96 |
2.3 |
-9.55 |
-0.68 |
0 |
|
|
287625 |
104249144 |
1 |
BrN2O2C16H17 |
AB2C2D16E17 |
-43.04 |
10.47 |
-9.26 |
-0.5 |
0 |
|
|
287626 |
104249165 |
1 |
BrN2O3C12H17 |
AB2C3D12E17 |
-108.84 |
10.22 |
-9.5 |
-0.5 |
0 |
|
|
287627 |
104249174 |
1 |
IN2O2C13H17 |
AB2C2D13E17 |
-42.09 |
10.16 |
-9.12 |
-0.8 |
0 |
|
|
287628 |
104249229 |
1 |
OCl2N2C10H12 |
AB2C2D10E12 |
-32.23 |
2.04 |
-9.85 |
-1.13 |
0 |
|
|
287629 |
104249242 |
1 |
BrOCl2N2C10H11 |
ABC2D2E10F11 |
-20.03 |
2.46 |
-9.86 |
-1.2 |
0 |
|
|
287630 |
104249299 |
1 |
ClOSN2C12H15 |
ABCD2E12F15 |
-28.72 |
1.48 |
-9.11 |
-0.95 |
0 |
|
|
287631 |
104249317 |
2 |
OC6H11 |
AB6C11 |
-118.62 |
3.53 |
-9.69 |
0.83 |
0 |
|
|
287632 |
104249475 |
2 |
OC7H10 |
AB7C10 |
-89.26 |
2.22 |
-9.22 |
0.2 |
0 |
|
|
287633 |
104249517 |
1 |
O2C13H18 |
A2B13C18 |
-80.54 |
3.66 |
-9.28 |
0.46 |
0 |
|
|
287634 |
104249557 |
2 |
NOC6H10 |
ABC6D10 |
-70.37 |
3.99 |
-9.3 |
0.61 |
0 |
|
|
287635 |
104249592 |
1 |
NSO2C11H15 |
ABC2D11E15 |
-65.8 |
1.8 |
-9.62 |
-0.7 |
0 |
|
|
287636 |
104249632 |
1 |
NO2C13H17 |
AB2C13D17 |
-72.7 |
3.71 |
-9.89 |
-0.78 |
0 |
|
|
287637 |
104249674 |
2 |
NOC6H9 |
ABC6D9 |
-60.8 |
1.64 |
-9.05 |
0.8 |
0 |
|
|
287638 |
104249679 |
1 |
O2C15H20 |
A2B15C20 |
-89.86 |
4.42 |
-9.37 |
-0.1 |
0 |
|
|
287639 |
104249692 |
1 |
N2O2C13H20 |
A2B2C13D20 |
-76.14 |
3.3 |
-9.57 |
-0.37 |
0 |
|
|
287640 |
104249696 |
1 |
O2C11H18 |
A2B11C18 |
-94.24 |
3.91 |
-9.82 |
0.57 |
0 |
|
|
287641 |
104249752 |
1 |
NO2C16H17 |
AB2C16D17 |
-45.77 |
1.1 |
-9.45 |
-1.0 |
0 |
|
|
287642 |
104249766 |
1 |
Cl2O2C13H14 |
A2B2C13D14 |
-87.69 |
5.0 |
-9.62 |
-0.9 |
0 |
|
|
287643 |
104249803 |
1 |
NO2C13H17 |
AB2C13D17 |
-70.1 |
2.78 |
-9.77 |
-0.28 |
0 |
|
|
287644 |
104250015 |
2 |
NOC5H9 |
ABC5D9 |
-84.05 |
2.96 |
-9.11 |
0.77 |
0 |
|
|
287645 |
104250041 |
1 |
BrO2C12H17 |
AB2C12D17 |
-86.92 |
4.43 |
-9.41 |
0.04 |
0 |
|
|
287646 |
104250042 |
1 |
O2C13H20 |
A2B13C20 |
-98.83 |
0.41 |
-9.13 |
0.51 |
0 |
|
|
287647 |
104250043 |
2 |
OC6H9 |
AB6C9 |
-89.39 |
0.68 |
-9.29 |
0.22 |
0 |
|
|
287648 |
104250103 |
1 |
O2F3C8H15 |
A2B3C8D15 |
-284.45 |
4.15 |
-10.12 |
1.73 |
0 |
|
|
287649 |
104250147 |
2 |
OC5H9 |
AB5C9 |
-98.46 |
3.65 |
-9.68 |
2.24 |
0 |
|
|
287650 |
104250263 |
1 |
ClN2O2C13H21 |
AB2C2D13E21 |
-95.48 |
2.89 |
-8.95 |
0.62 |
0 |
|
|
287651 |
104250328 |
1 |
N2O2C11H18 |
A2B2C11D18 |
-70.95 |
2.44 |
-9.59 |
0.54 |
0 |
|
|
287652 |
104250390 |
1 |
O2C13H24 |
A2B13C24 |
-135.75 |
3.09 |
-9.66 |
2.37 |
0 |
|
|
287653 |
104250485 |
1 |
NO2C9H15 |
AB2C9D15 |
-65.95 |
2.27 |
-9.42 |
0.32 |
0 |
|
|
287654 |
104250512 |
1 |
NOC10H19 |
ABC10D19 |
-18.36 |
3.23 |
-9.35 |
1.76 |
0 |
|
|
287655 |
104250521 |
1 |
BrNOSC10H16 |
ABCDE10F16 |
-34.35 |
2.09 |
-9.16 |
-0.41 |
0 |
|
|
287656 |
104250549 |
1 |
NOCl2C11H15 |
ABC2D11E15 |
-52.81 |
2.07 |
-9.6 |
-0.64 |
0 |
|
|
287657 |
104250646 |
1 |
ON4C11H22 |
AB4C11D22 |
-26.59 |
4.68 |
-9.68 |
0.4 |
0 |
|
|
287658 |
104250677 |
1 |
NO3C15H23 |
AB3C15D23 |
-109.44 |
3.4 |
-8.55 |
0.32 |
0 |
|
|
287659 |
104250713 |
1 |
NOC12H27 |
ABC12D27 |
-90.95 |
1.82 |
-8.95 |
2.47 |
0 |
|
|
287660 |
104250734 |
1 |
NOF2C13H19 |
ABC2D13E19 |
-134.26 |
2.45 |
-8.97 |
-0.3 |
0 |
|
|
287661 |
104250768 |
1 |
ON3C13H25 |
AB3C13D25 |
-36.54 |
2.74 |
-8.94 |
0.97 |
0 |
|
|
287662 |
104250999 |
1 |
NO2C11H19 |
AB2C11D19 |
-70.47 |
0.99 |
-8.98 |
0.52 |
0 |
|
|
287663 |
104251036 |
1 |
NO2C17H27 |
AB2C17D27 |
-88.02 |
4.63 |
-8.32 |
0.44 |
0 |
|
|
287664 |
104251080 |
1 |
ON2C15H26 |
AB2C15D26 |
-50.43 |
2.58 |
-8.92 |
0.02 |
0 |
|
|
287665 |
104251106 |
1 |
BrON3C15H28 |
ABC3D15E28 |
-46.79 |
4.68 |
-8.98 |
0.23 |
0 |
|
|
287666 |
104251167 |
1 |
NO2C11H25 |
AB2C11D25 |
-118.27 |
2.47 |
-8.95 |
2.07 |
0 |
|
|
287667 |
104251232 |
1 |
NOC11H25 |
ABC11D25 |
-83.45 |
1.8 |
-8.76 |
2.55 |
0 |
|
|
287668 |
104251306 |
1 |
NOC17H29 |
ABC17D29 |
-62.76 |
2.42 |
-8.92 |
0.42 |
0 |
|
|
287669 |
104251307 |
1 |
FNO2C15H24 |
ABC2D15E24 |
-127.33 |
4.87 |
-8.84 |
0.0 |
0 |
|
|
287670 |
104251311 |
1 |
ON3C12H23 |
AB3C12D23 |
-23.47 |
2.58 |
-9.08 |
0.77 |
0 |
|
|
287671 |
104251403 |
1 |
NO3C16H27 |
AB3C16D27 |
-127.65 |
1.87 |
-8.77 |
0.32 |
0 |
|
|
287672 |
104251408 |
2 |
NOC8H14 |
ABC8D14 |
-86.99 |
4.89 |
-9.01 |
-0.13 |
0 |
|
|
287673 |
104251440 |
1 |
NO2C12H27 |
AB2C12D27 |
-124.32 |
1.59 |
-8.89 |
1.99 |
0 |
|
|
287674 |
104251487 |
1 |
NOSC11H17 |
ABCD11E17 |
-34.66 |
2.74 |
-9.15 |
-0.2 |
0 |
|
|
287675 |
104251500 |
1 |
NOC18H27 |
ABC18D27 |
-60.65 |
1.28 |
-8.93 |
0.4 |
0 |
|
|
287676 |
104251502 |
1 |
ON3C11H19 |
AB3C11D19 |
-32.33 |
3.84 |
-9.12 |
0.8 |
0 |
|
|
287677 |
104251570 |
1 |
NO3C15H21 |
AB3C15D21 |
-112.75 |
3.81 |
-8.65 |
0.11 |
0 |
|
|
287678 |
104251627 |
1 |
OSN2C12H20 |
ABC2D12E20 |
-42.93 |
1.88 |
-9.16 |
-0.32 |
0 |
|
|
287679 |
104251631 |
1 |
NO2C16H25 |
AB2C16D25 |
-87.39 |
3.52 |
-8.37 |
0.64 |
0 |
|
|
287680 |
104251661 |
1 |
NOC11H21 |
ABC11D21 |
-56.63 |
1.85 |
-9.26 |
2.33 |
0 |
|
|
287681 |
104251684 |
1 |
NOSC12H19 |
ABCD12E19 |
-38.7 |
2.25 |
-8.92 |
-0.18 |
0 |
|
|
287682 |
104251690 |
1 |
ON2C16H20 |
AB2C16D20 |
-12.04 |
1.79 |
-9.25 |
-0.91 |
0 |
|
|
287683 |
104251783 |
1 |
NSO3C15H29 |
ABC3D15E29 |
-166.07 |
5.33 |
-8.82 |
0.91 |
0 |
|
|
287684 |
104251795 |
1 |
ClFNOC15H21 |
ABCDE15F21 |
-96.45 |
1.24 |
-8.82 |
-0.23 |
0 |
|
|
287685 |
104251797 |
1 |
NOC15H31 |
ABC15D31 |
-99.53 |
1.75 |
-8.93 |
2.34 |
0 |
|
|
287686 |
104251863 |
1 |
NOC14H21 |
ABC14D21 |
-36.44 |
2.31 |
-9.0 |
0.3 |
0 |
|
|
287687 |
104251884 |
1 |
ON3C14H25 |
AB3C14D25 |
-43.76 |
6.33 |
-9.1 |
0.71 |
0 |
|
|
287688 |
104251918 |
1 |
NO2C13H25 |
AB2C13D25 |
-115.76 |
2.38 |
-8.93 |
2.31 |
0 |
|
|
287689 |
104251919 |
1 |
ON3C13H21 |
AB3C13D21 |
-29.28 |
2.48 |
-8.6 |
0.13 |
0 |
|
|
287690 |
104251927 |
1 |
ON4C15H28 |
AB4C15D28 |
-37.66 |
4.11 |
-9.02 |
0.33 |
0 |
|
|
287691 |
104251997 |
1 |
ON3C15H27 |
AB3C15D27 |
-42.81 |
5.17 |
-8.77 |
0.8 |
0 |
|
|
287692 |
104252010 |
1 |
NOC14H29 |
ABC14D29 |
-95.62 |
3.16 |
-8.9 |
2.63 |
0 |
|
|
287693 |
104252074 |
1 |
ON3C13H21 |
AB3C13D21 |
-20.59 |
2.37 |
-9.1 |
-0.76 |
0 |
|
|
287694 |
104252109 |
1 |
ON3C15H25 |
AB3C15D25 |
-40.1 |
3.72 |
-8.76 |
0.21 |
0 |
|
|
287695 |
104252111 |
1 |
NSO3C13H27 |
ABC3D13E27 |
-168.13 |
4.27 |
-8.76 |
0.96 |
0 |
|
|
287696 |
104252139 |
1 |
FON2C14H21 |
ABC2D14E21 |
-78.76 |
2.32 |
-9.24 |
-0.48 |
0 |
|
|
287697 |
104252141 |
1 |
NO2C15H29 |
AB2C15D29 |
-131.25 |
2.24 |
-8.96 |
2.28 |
0 |
|
|
287698 |
104252209 |
1 |
NOC18H29 |
ABC18D29 |
-65.73 |
3.04 |
-8.75 |
0.36 |
0 |
|
|
287699 |
104252247 |
1 |
ON3C15H27 |
AB3C15D27 |
-40.29 |
3.45 |
-8.95 |
0.65 |
0 |