Geometry & MOs

Info

ID:	393952
PubChem CID:	135022041
Reduced:	OC15H20 (1)
Stoich.:	AB15C20 (1)
Weight, g/mol:	210.16198
ΔH_f, kcal/mol:	-22.17
Dipole, Da:	2.65
IP(EA), eV:	-9.36(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E,6R)-2,6-dimethylundec-8-en-10-yne-2,3-diol

Drug info:

PubChemData

Smile

C1CCC2(CC1)C(O2)CCC3=CC=CC=C3

DOS

IR

Vibrations