Geometry & MOs

Info

ID:	383507
PubChem CID:	134975263
Reduced:	O7C13H24 (1)
Stoich.:	A7B13C24 (1)
Weight, g/mol:	599.323345
ΔH_f, kcal/mol:	-332.12
Dipole, Da:	1.32
IP(EA), eV:	-10.42(0.38)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

methyl (2S)-2-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoylamino]-3-(1-methyl-3-trityl-1,2-dihydroimidazol-1-ium-5-yl)propanoate

Drug info:

PubChemData

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C[C@]1(CC[C@@H](O1)[C@](C)(COCOC)O)[C@@H](C(=O)OC)O

DOS

IR

Vibrations