4-[(1E)-3-Methyl-1,3-Butadien-1-Yl]-1H-Indole-3-Carbaldehyde

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Properties Simple | Detailed

Formula C14H13NO
IUPAC Name 4-[(1e)-3-methylbuta-1,3-dienyl]indol-1-ium-3-carbaldehyde
Molecular Mass 211.259 g·mol−1
Heat of Formation 119.3 ± 16.7 kJ·mol−1
Dipole Moment 3.71 ± 1.08 D
Volume 267.31 Å 3
Surface Area 251.09 Å 2
HOMO Energy -8.82 ± 0.55 eV
LUMO Energy -0.65 ± eV
Point Group Symmetry C1
InChIKey AXOXRKLGTGXWJN-VOTSOKGWSA-N
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