Geometry & MOs

Info

ID:	172274
PubChem CID:	75487574
Reduced:	OC6H10 (2)
Stoich.:	AB6C10 (2)
Weight, g/mol:	428.219889
ΔH_f, kcal/mol:	-122.67
Dipole, Da:	2.52
IP(EA), eV:	-9.62(2.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3S,4S,5R,6R)-2-pent-4-enoxy-4-phenylmethoxy-6-(phenylmethoxymethyl)oxane-3,5-diol

Drug info:

PubChemData

Smile

COC12C[C@@H]3C[C@H](C1)CC(C3)(C2)CO

DOS

IR

Vibrations