Geometry & MOs

Info

ID:	260012
PubChem CID:	103179121
Reduced:	NO5C13H19 (1)
Stoich.:	AB5C13D19 (1)
Weight, g/mol:	283.178358
ΔH_f, kcal/mol:	-187.86
Dipole, Da:	8.7
IP(EA), eV:	-8.76(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[2-(3-methoxypropoxy)ethoxy]-6-propan-2-ylpyridin-4-yl]methanol

Drug info:

PubChemData

Smile

COCCCOCCOC1=C(C=C(C=C1)C(=O)O)N

DOS

IR

Vibrations