4,4'-{[(1S,3S)-2-Oxo-1,3-Cycloheptanediyl]Bis(Methylene)}Dibenzenecarboximidamide

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Properties Simple | Detailed

Formula C23H28N4O
IUPAC Name 4-[[(1s,3s)-3-[(4-carbamimidoylphenyl)methyl]-2-oxo-cycloheptyl]methyl]benzamidine
Molecular Mass 376.495 g·mol−1
Heat of Formation 36.5 ± 16.7 kJ·mol−1
Dipole Moment 7.45 ± 1.08 D
Volume 477.87 Å 3
Surface Area 378.19 Å 2
HOMO Energy -9.43 ± 0.55 eV
LUMO Energy 2.62 ± eV
Point Group Symmetry C1
InChIKey BXYGSMRTHHSAHZ-PMACEKPBSA-N
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