Geometry & MOs

Info

ID:	409807
PubChem CID:	135082593
Reduced:	O9C26H32 (1)
Stoich.:	A9B26C32 (1)
Weight, g/mol:	212.138858
ΔH_f, kcal/mol:	-389.37
Dipole, Da:	4.63
IP(EA), eV:	-9.86(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

lithium;(2R,6R)-4,4,6-trimethyl-2-phenyl-1,3-dioxane

Drug info:

PubChemData

Smile

C1CCC2(CC1)OCC(O2)[C@@H]3[C@@H]([C@@H]4[C@H](O3)OC5(O4)CCCCC5)OC(=O)C6=CC=CC=C6C(=O)O

DOS

IR

Vibrations