7-(1-Aziridinyl)-5,8-Dihydroxy-6,9-Dimethyl-2,3-Dihydro-1H-Pyrrolo[1,2-A]Indol-1-Yl Acetate

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Properties Simple | Detailed

Formula C17H20N2O4
IUPAC Name [(3s)-6-(aziridin-1-yl)-5,8-dihydroxy-4,7-dimethyl-2,3-dihydro-1h-pyrrolo[1,2-a]indol-9-ium-3a-ylium-3-yl] acetate
Molecular Mass 316.352 g·mol−1
Heat of Formation -448.5 ± 16.7 kJ·mol−1
Dipole Moment 4.04 ± 1.08 D
Volume 371.05 Å 3
Surface Area 325.25 Å 2
HOMO Energy -7.57 ± 0.55 eV
LUMO Energy 0.05 ± eV
Point Group Symmetry C1
InChIKey YILBZZIHASXZNW-NSHDSACASA-N
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