N-{[12-Cyano-7,18-Dimethoxy-6,17,21-Trimethyl-5,8,16,19-Tetraoxo-11,21-Diazapentacyclo[11.7.1.0~2,11~.0~4,9~.0~15,20~]Henicosa-4(9),6,15(20),17-Tetraen-10-Yl]Methyl}-2-Oxobutanamide

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Properties Simple | Detailed

Formula C30H32N4O8
IUPAC Name saframycin ad1
Molecular Mass 576.597 g·mol−1
Heat of Formation -821.1 ± 16.7 kJ·mol−1
Dipole Moment 3.31 ± 1.08 D
Volume 651.61 Å 3
Surface Area 500.04 Å 2
HOMO Energy -9.46 ± 0.55 eV
LUMO Energy 1.04 ± eV
Point Group Symmetry C1
InChIKey GGGQHIDQYVATGY-UIOOOSCTSA-N
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