Geometry & MOs

Info

ID:	381520
PubChem CID:	134972283
Reduced:	O2C23H28 (1)
Stoich.:	A2B23C28 (1)
Weight, g/mol:	354.219495
ΔH_f, kcal/mol:	-3.44
Dipole, Da:	0.71
IP(EA), eV:	-9.32(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R,5S)-5-methyl-3,8-bis(phenylmethoxy)octan-2-one

Drug info:

PubChemData

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C[C@@H](CCCOCC1=CC=CC=C1)C[C@H](C#C)OCC2=CC=CC=C2

DOS

IR

Vibrations