Geometry & MOs

Info

ID:	14137
PubChem CID:	405098
Reduced:	O7C34H34 (1)
Stoich.:	A7B34C34 (1)
Weight, g/mol:	554.230453
ΔH_f, kcal/mol:	-184.75
Dipole, Da:	1.2
IP(EA), eV:	-8.46(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,4S)-3-hydroxy-3,4-bis[(3-methoxy-4-phenylmethoxyphenyl)methyl]oxolan-2-one

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)C[C@H]2COC(=O)[C@@]2(CC3=CC(=C(C=C3)OCC4=CC=CC=C4)OC)O)OCC5=CC=CC=C5

DOS

IR

Vibrations