Geometry & MOs

Info

ID:	393019
PubChem CID:	135018986
Reduced:	O3C19H34 (1)
Stoich.:	A3B19C34 (1)
Weight, g/mol:	238.156895
ΔH_f, kcal/mol:	-158.28
Dipole, Da:	2.32
IP(EA), eV:	-10.05(1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,6S)-6-[(E,2R)-2-hydroxypent-3-en-2-yl]-4-methyl-2-prop-2-enyl-2,3-dihydropyran-6-ol

Drug info:

PubChemData

Smile

CCCCCC#C[C@]1(CCC[C@@H]1CCCCC(OC)OC)O

DOS

IR

Vibrations