N-[2-(3,4-Dimethoxyphenyl)Ethyl]-4-[5-Methoxy-2-(Phenylethynyl)Phenyl]-N-Methyl-2-Butanamine

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Formula C30H35NO3
IUPAC Name (2s)-n-[2-(3,4-dimethoxyphenyl)ethyl]-4-[5-methoxy-2-(2-phenylethynyl)phenyl]-n-methyl-butan-2-amine
Molecular Mass 457.604 g·mol−1
Heat of Formation -54.4 ± 16.7 kJ·mol−1
Dipole Moment 1.46 ± 1.08 D
Volume 594.53 Å 3
Surface Area 494.0 Å 2
HOMO Energy -8.47 ± 0.55 eV
LUMO Energy -0.53 ± eV
Point Group Symmetry C1
InChIKey HQDXNTRZJRNPLD-HSZRJFAPSA-N
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