4-(4-Carbamoylphenyl)-N,N-Bis(2-Hydroxy-2-Phenylethyl)-2-Butanaminium

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Formula C27H32N2O3
IUPAC Name 4-[(3s)-3-[[(2r)-2-hydroxy-2-phenyl-ethyl]-[(2s)-2-hydroxy-2-phenyl-ethyl]amino]butyl]benzamide
Molecular Mass 432.555 g·mol−1
Heat of Formation -357.0 ± 16.7 kJ·mol−1
Dipole Moment 4.34 ± 1.08 D
Volume 554.1 Å 3
Surface Area 445.7 Å 2
HOMO Energy -9.05 ± 0.55 eV
LUMO Energy -0.36 ± eV
Point Group Symmetry C1
InChIKey OPPQEWZOPDBGAS-YMSRPXOMSA-N
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