Geometry & MOs

Info

ID:	394077
PubChem CID:	135022296
Reduced:	O6C23H26 (1)
Stoich.:	A6B23C26 (1)
Weight, g/mol:	160.109944
ΔH_f, kcal/mol:	-211.95
Dipole, Da:	1.95
IP(EA), eV:	-9.31(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,4R)-4-(methoxymethoxy)hex-5-en-2-ol

Drug info:

PubChemData

Smile

C[C@@H]1C[C@@H](C=CCC2=C(C(=CC(=C2)OCC3=CC=CC=C3)O)C(=O)O1)OCOC

DOS

IR

Vibrations