Geometry & MOs

Info

ID:	394926
PubChem CID:	135024179
Reduced:	O4C13H17 (2)
Stoich.:	A4B13C17 (2)
Weight, g/mol:	474.188983
ΔH_f, kcal/mol:	-282.06
Dipole, Da:	1.9
IP(EA), eV:	-8.59(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R,5R)-4-[(2S,4S,6R)-4-(methoxymethoxy)-6-[3-methoxy-4-(methoxymethoxy)phenyl]oxan-2-yl]-5-phenyl-1,3-dioxolan-2-one

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations