Geometry & MOs

Info

ID:	285796
PubChem CID:	104132879
Reduced:	FNO3C16H16 (1)
Stoich.:	ABC3D16E16 (1)
Weight, g/mol:	295.178358
ΔH_f, kcal/mol:	-129.3
Dipole, Da:	7.13
IP(EA), eV:	-9.63(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-tert-butyl-6-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pyridine-4-carboxylic acid

Drug info:

PubChemData

Smile

CCCC1=NC(=CC(=C1)C(=O)O)OC2=C(C=CC(=C2)C)F

DOS

IR

Vibrations