Geometry & MOs

Info

ID:	388576
PubChem CID:	134989538
Reduced:	IO3C13H23 (1)
Stoich.:	AB3C13D23 (1)
Weight, g/mol:	262.02046
ΔH_f, kcal/mol:	-153.75
Dipole, Da:	4.03
IP(EA), eV:	-9.92(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (1S)-1-bromo-2-oxocycloheptane-1-carboxylate

Drug info:

PubChemData

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CC(C)C[C@H]([C@@H]1C[C@@H](C(=O)O1)OCC(C)C)I

DOS

IR

Vibrations