PM7 Accuracy
Date:Mon Feb 11 04:20:05 2019
zirconium tetra(dimethylamine)
4650 Zirconium tetra(dimethylamine)
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ΔHf: -69.8 kcal/mol, REF: NIST Chemistry WebBook, NIST Standard Reference Database, No. 69; W. G. Mallard, P. J. Linstrom, Eds., National Institute of Standards and Technology, Gaithersberg, http://webbook.nist.gov/chemistry.
PM7
Zirconium tetra(dimethylamine)
H=-69.79 HR=NIST
Zr 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
N 2.17377066 +1 0.0000000 +0 0.0000000 +0 1 0 0
C 1.45394354 +1 129.2278386 +1 0.0000000 +0 2 1 0
H 1.10455043 +1 112.4223395 +1 -114.3751049 +1 3 2 1
C 1.45941779 +1 116.2445829 +1 -174.3716111 +1 2 1 3
N 2.17414765 +1 109.2828765 +1 -70.6794398 +1 1 2 3
H 1.10378148 +1 112.4736756 +1 115.3357771 +1 5 2 1
C 3.23955998 +1 104.8470286 +1 -169.0303775 +1 1 2 3
H 1.10422424 +1 129.7283909 +1 -35.8993320 +1 8 1 2
N 2.17384527 +1 110.4929129 +1 49.4684003 +1 1 2 3
C 3.16709207 +1 115.8126463 +1 144.2926405 +1 1 2 3
H 1.10369672 +1 119.7485417 +1 166.4751369 +1 11 1 2
C 1.45855886 +1 118.3798096 +1 6.2752783 +1 6 1 2
N 2.18004999 +1 108.8889954 +1 168.7129417 +1 1 2 3
H 1.10386865 +1 112.1057286 +1 122.0951696 +1 13 6 1
C 1.45502275 +1 127.0734101 +1 -166.9492699 +1 6 1 2
H 1.10452640 +1 112.0621651 +1 -123.1531144 +1 16 6 1
C 1.45520978 +1 126.3923734 +1 41.3902106 +1 10 1 2
H 1.10445073 +1 111.9972466 +1 123.6961246 +1 18 10 1
C 1.45830727 +1 118.8983911 +1 -130.4831438 +1 10 1 2
H 1.10375761 +1 112.5989525 +1 115.1942350 +1 20 10 1
H 1.10438047 +1 112.1699986 +1 123.6732192 +1 3 2 1
H 1.10608316 +1 108.3938774 +1 4.5215412 +1 3 2 1
H 1.11222513 +1 108.0738575 +1 -3.3711014 +1 5 2 1
H 1.10355232 +1 112.2189862 +1 -122.3335624 +1 5 2 1
H 1.10425441 +1 107.9947691 +1 124.5977598 +1 8 9 14
H 1.10701751 +1 108.0156749 +1 -119.2275228 +1 8 9 14
H 1.11009004 +1 107.5478530 +1 -119.0000608 +1 11 12 14
H 1.10349436 +1 108.4063792 +1 124.4110153 +1 11 12 14
H 1.10369289 +1 112.5541687 +1 -115.6356901 +1 13 6 1
H 1.11086793 +1 108.1104840 +1 3.1850036 +1 13 6 1
H 1.10642370 +1 108.4339080 +1 -4.0704153 +1 16 6 1
H 1.10433502 +1 112.5042259 +1 114.9061145 +1 16 6 1
H 1.10680464 +1 108.3717061 +1 4.6753837 +1 18 10 1
H 1.10420266 +1 112.5851729 +1 -114.2951337 +1 18 10 1
H 1.10393383 +1 112.0382660 +1 -122.5597359 +1 20 10 1
H 1.11041283 +1 108.1616280 +1 -3.6165253 +1 20 10 1