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

Molecule SVG Image

Properties Simple | Detailed

Formula C38H35N2O6+
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 615.694 g·mol−1
Heat of Formation 5102.0 ± 16.7 kJ·mol−1
Dipole Moment 10.30 ± 1.08 D
Volume 655.45 Å 3
Surface Area 535.14 Å 2
HOMO Energy -8.50 ± 0.55 eV
LUMO Energy -3.35 ± eV
Point Group Symmetry C1
InChIKey IAFYZOROUCWFHK-HQILYBJNSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements C O N