(2R,3R,4S,5R,8S,10S,15R,16R)-3,4,8,10,14,15-Hexahydroxy-7,9,11,25,26-Pentaoxa-1,17,19,22-Tetraaza-8,10-Diphosphapentacyclo[18.3.1.1~2,5~.1~13,16~.0~17,21~]Hexacosa-18,20,22-Trien-24-One 8,10-Dioxide

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Formula C15H8N4O14P2
IUPAC Name (2r,3r,4s,5r,8s,10s,15r,16r)-3,4,8,10,14,15-hexahydroxy-7,9,11,25,26-pentaoxa-1,17,19,22-tetraaza-8,10-diphosphapentacyclo[18.3.1.1 2,5 .1 13,16 .0 17,21 ]hexacosa-18,20,22-trien-24-one 8,10-dioxide
Molecular Mass 530.190 g·mol−1
Heat of Formation -1018.2 ± 16.7 kJ·mol−1
Dipole Moment 8.41 ± 1.08 D
Volume 480.67 Å 3
Surface Area 421.39 Å 2
HOMO Energy -9.45 ± 0.55 eV
LUMO Energy -2.96 ± eV
Point Group Symmetry C1
InChIKey REBZYOYBILSKBL-RYHVWOEXSA-N
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