Geometry & MOs

Info

ID:	383579
PubChem CID:	134975373
Reduced:	O7C14H22 (1)
Stoich.:	A7B14C22 (1)
Weight, g/mol:	236.141244
ΔH_f, kcal/mol:	-342.01
Dipole, Da:	3.39
IP(EA), eV:	-10.08(0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-[(4-methoxyphenyl)methoxy]-4-methylpent-4-en-1-ol

Drug info:

PubChemData

Smile

C[C@@H]1C(O[C@H](C(C1OC(=O)C)OC(=O)C)C)COC(=O)C

DOS

IR

Vibrations