Geometry & MOs

Info

ID:	390425
PubChem CID:	134999114
Reduced:	O8C11H20 (1)
Stoich.:	A8B11C20 (1)
Weight, g/mol:	228.172545
ΔH_f, kcal/mol:	-359.22
Dipole, Da:	3.43
IP(EA), eV:	-10.39(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,2R)-1-cyclohexyl-1-(methoxymethoxy)pent-4-en-2-ol

Drug info:

PubChemData

Smile

COC(=O)C(=C)C[C@H]([C@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O)O

DOS

IR

Vibrations