N-(4-Carbamimidoylbenzyl)-1-(3-Cyclohexylpropanoyl)-L-Prolinamide

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Properties Simple | Detailed

Formula C22H32N4O2
IUPAC Name (2s)-n-[(4-carbamimidoylphenyl)methyl]-1-(3-cyclohexylpropanoyl)pyrrolidine-2-carboxamide
Molecular Mass 384.515 g·mol−1
Heat of Formation -360.8 ± 16.7 kJ·mol−1
Dipole Moment 6.63 ± 1.08 D
Volume 486.74 Å 3
Surface Area 433.47 Å 2
HOMO Energy -9.37 ± 0.55 eV
LUMO Energy 2.95 ± eV
Point Group Symmetry C1
InChIKey DOTBZTLJSXFKCP-IBGZPJMESA-N
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