2-({(2S)-1-Amino-5-[(2-Chloroethanimidoyl)Amino]-1-Oxo-2-Pentanyl}Carbamoyl)Benzoic Acid

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Properties Simple | Detailed

Formula C15H19ClN4O4
IUPAC Name 2-[[(1s)-1-carbamoyl-4-[(2-chloroethanimidoyl)amino]butyl]carbamoyl]benzoic acid
Molecular Mass 354.789 g·mol−1
Heat of Formation -633.3 ± 16.7 kJ·mol−1
Dipole Moment 6.26 ± 1.08 D
Volume 411.74 Å 3
Surface Area 368.44 Å 2
HOMO Energy -9.44 ± 0.55 eV
LUMO Energy -1.05 ± eV
Point Group Symmetry C1
InChIKey VUCFCRGOVAAFJN-NSHDSACASA-N
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Elements H C N O Cl