Geometry & MOs

Info

ID:	85050
PubChem CID:	49871463
Reduced:	O2C15H24 (1)
Stoich.:	A2B15C24 (1)
Weight, g/mol:	308.235145
ΔH_f, kcal/mol:	-124.38
Dipole, Da:	4.82
IP(EA), eV:	-9.7(0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[(1R,2S,5S,9R)-5-methyl-2-propan-2-yl-12-oxatricyclo[7.2.1.01,5]dodecan-7-yl]acetate

Drug info:

PubChemData

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CC(C)[C@@H]1CC[C@@]2([C@@]13CC[C@@H](O3)CC(=O)C2)C

DOS

IR

Vibrations