Agelastatin F

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Properties Simple | Detailed

Formula C11H10Br2N4O3
IUPAC Name agelastatin f
Molecular Mass 406.030 g·mol−1
Heat of Formation -315.0 ± 16.7 kJ·mol−1
Dipole Moment 3.51 ± 1.08 D
Volume 326.67 Å 3
Surface Area 284.76 Å 2
HOMO Energy -9.35 ± 0.55 eV
LUMO Energy -0.66 ± eV
Point Group Symmetry C1
InChIKey XDTDQGZBMQLKIM-MNRJBDMISA-N
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Elements H C O Br N