7-[[6-[[1-(1-Iminoethyl)Piperidin-4-Yl]Oxy]-2-Methyl-Benzimidazol-1-Yl]Methyl]Naphthalene-2-Carboximidamid

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Properties Simple | Detailed

Formula C27H31N6O+
IUPAC Name 7-[[6-[(1-ethanimidoyl-4-piperidyl)oxy]-2-methyl-3h-benzimidazol-1-ium-1-yl]methyl]naphthalene-2-carboxamidine
Molecular Mass 455.575 g·mol−1
Heat of Formation 4043.8 ± 16.7 kJ·mol−1
Dipole Moment 4.61 ± 1.08 D
Volume 509.63 Å 3
Surface Area 449.39 Å 2
HOMO Energy -8.61 ± 0.55 eV
LUMO Energy -2.59 ± eV
Point Group Symmetry C1
InChIKey JABMRQOJSAZJAD-QRQIAZFYSA-O
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