(1R,4As,4Br,6As,10As,10Br,12As)-4B,7,7,10A,12A-Pentamethyl-1,4,4A,4B,5,6,6A,7,8,9,10,10A,10B,11,12,12A-Hexadecahydro-1,2-Chrysenedicarbaldehyde

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Formula C25H38O2
IUPAC Name (1r,4as,4br,6as,10as,10br,12as)-4b,7,7,10a,12a-pentamethyl-1,4,4a,5,6,6a,8,9,10,10b,11,12-dodecahydrochrysene-1,2-dicarbaldehyde
Molecular Mass 370.568 g·mol−1
Heat of Formation -461.2 ± 16.7 kJ·mol−1
Dipole Moment 5.20 ± 1.08 D
Volume 478.78 Å 3
Surface Area 360.36 Å 2
HOMO Energy -9.72 ± 0.55 eV
LUMO Energy 0.43 ± eV
Point Group Symmetry C1
Synonyms
  • (1r,4as,4br,6as,10as,10br,12as)-4b,7,7,10a,12a-pentamethyl-1,4,4a,5,6,6a,8,9,10,10b,11,12-dodecahydrochrysene-1,2-dicarbaldehyde
  • (1r,4as,4br,6as,10as,10br,12as)-4b,7,7,10a,12a-pentamethyl-1,4,4a,5,6,6a,8,9,10,10b,11,12-dodecahydrochrysene-1,2-dicarboxaldehyde
InChIKey QNKOIQITFODMFG-RNDOZLNUSA-N
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