Geometry & MOs

Info

ID:	394924
PubChem CID:	135024177
Reduced:	O7C25H34 (1)
Stoich.:	A7B25C34 (1)
Weight, g/mol:	356.183503
ΔH_f, kcal/mol:	-262.11
Dipole, Da:	2.01
IP(EA), eV:	-8.47(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2R,4R,6R)-4-(methoxymethoxy)-6-[3-methoxy-4-(methoxymethoxy)phenyl]oxan-2-yl]ethanol

Drug info:

PubChemData

Smile

COCO[C@@H]1C[C@H](O[C@H](C1)C2=CC(=C(C=C2)OCOC)OC)CCOCC3=CC=CC=C3

DOS

IR

Vibrations