Geometry & MOs

Info

ID:	389452
PubChem CID:	134992992
Reduced:	OC6H9 (2)
Stoich.:	AB6C9 (2)
Weight, g/mol:	242.22458
ΔH_f, kcal/mol:	-83.37
Dipole, Da:	4.43
IP(EA), eV:	-9.88(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R,4R)-3-ethoxytridec-1-en-4-ol

Drug info:

PubChemData

Smile

C1CCC(CC1)C(=O)/C=C\CCC=O

DOS

IR

Vibrations