(2S,3R,4E,6R)-4-(Hydroxyimino)-3-Methoxy-2-Methyl-29-Oxa-1,7,17-Triazaoctacyclo[12.12.2.1~2,6~.0~7,28~.0~8,13~.0~15,19~.0~20,27~.0~21,26~]Nonacosa-8,10,12,14,19,21,23,25,27-Nonaen-16-One

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Formula C27H17N4O4
IUPAC Name (2s,3r,4e,6r)-4-(hydroxyimino)-3-methoxy-2-methyl-29-oxa-1,7,17-triazaoctacyclo[12.12.2.1 2,6 .0 7,28 .0 8,13 .0 15,19 .0 20,27 .0 21,26 ]nonacosa-8,10,12,14,19,21,23,25,27-nonaen-16-one
Molecular Mass 461.448 g·mol−1
Heat of Formation 3608.6 ± 16.7 kJ·mol−1
Dipole Moment 16.69 ± 1.08 D
Volume 460.63 Å 3
Surface Area 374.79 Å 2
HOMO Energy -8.17 ± 0.55 eV
LUMO Energy -4.42 ± eV
Point Group Symmetry C1
InChIKey XZPCNXORIOQSOG-SWHIWACISA-N
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