Geometry & MOs

Info

ID:	391897
PubChem CID:	135010718
Reduced:	O4C9H18 (1)
Stoich.:	A4B9C18 (1)
Weight, g/mol:	420.233431
ΔH_f, kcal/mol:	-198.33
Dipole, Da:	2.41
IP(EA), eV:	-9.52(1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl (2R,3S)-2-pentyl-3-(phenylsulfanylmethyl)-4-propylcyclopentane-1,1-dicarboxylate

Drug info:

PubChemData

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C[C@H]([C@H]1[C@H](OC(O1)(C)C)OC)OC

DOS

IR

Vibrations