Geometry & MOs

Info

ID:	340482
PubChem CID:	127262493
Reduced:	NO3C14H17 (1)
Stoich.:	AB3C14D17 (1)
Weight, g/mol:	257.141579
ΔH_f, kcal/mol:	-98.46
Dipole, Da:	2.5
IP(EA), eV:	-8.63(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,4-diethylphenyl) 4H-pyridine-1-carboxylate

Drug info:

PubChemData

Smile

CC(COC(=O)N1CC=CC2=CC=CC=C21)OC

DOS

IR

Vibrations