Geometry & MOs

Info

ID:	313133
PubChem CID:	126612132
Reduced:	O2C7H14 (2)
Stoich.:	A2B7C14 (2)
Weight, g/mol:	896.395805
ΔH_f, kcal/mol:	-224.12
Dipole, Da:	5.04
IP(EA), eV:	-9.58(1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,6S)-2-[[(2S,5S)-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]sulfanylmethyl]-6-methoxy-3,4,5-tris(phenylmethoxy)oxane

Drug info:

PubChemData

Smile

CCCCO[C@H]1C(OC(CC1OCCCC)O)C

DOS

IR

Vibrations