3-{4-[(6,7-Dimethoxy-2-Methyl-1,2,3,4-Tetrahydro-1-Isoquinolinyl)Methyl]Phenoxy}-5',6'-Dimethoxy-1'-Methyl-2',3',8',8A'-Tetrahydro-1'H,4H-Spiro[Cyclohexa-2,5-Diene-1,7'-Cyclopenta[Ij]Isoquinolin]-4-One

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Formula C38H42N2O6
IUPAC Name 3-{4-[(6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydro-1-isoquinolinyl)methyl]phenoxy}-5',6'-dimethoxy-1'-methyl-2',3',8',8a'-tetrahydro-1'h,4h-spiro[cyclohexa-2,5-diene-1,7'-cyclopenta[ij]isoquinolin]-4-one
Molecular Mass 622.750 g·mol−1
Heat of Formation -462.2 ± 16.7 kJ·mol−1
Dipole Moment 5.52 ± 1.08 D
Volume 757.36 Å 3
Surface Area 578.71 Å 2
HOMO Energy -8.53 ± 0.55 eV
LUMO Energy -0.53 ± eV
Point Group Symmetry C1
InChIKey IAFYZOROUCWFHK-HXUMPODJSA-N
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