N-({1-Carboxy-4-[(Diaminomethylene)Amino]Butyl}Carbamoyl)-L-Phenylalanine

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Properties Simple | Detailed

Formula C16H23N5O5
IUPAC Name (2s)-2-[[(1s)-1-carboxy-2-phenyl-ethyl]carbamoylamino]-5-guanidino-pentanoic acid
Molecular Mass 365.384 g·mol−1
Heat of Formation -843.3 ± 16.7 kJ·mol−1
Dipole Moment 4.92 ± 1.08 D
Volume 442.08 Å 3
Surface Area 371.81 Å 2
HOMO Energy -9.44 ± 0.55 eV
LUMO Energy 0.09 ± eV
Point Group Symmetry C1
InChIKey AFUDERYHOUWFDT-RYUDHWBXSA-N
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