Geometry & MOs

Info

ID:	275966
PubChem CID:	103819523
Reduced:	BrN2O2C12H15 (1)
Stoich.:	AB2C2D12E15 (1)
Weight, g/mol:	209.105193
ΔH_f, kcal/mol:	-78.01
Dipole, Da:	4.33
IP(EA), eV:	-9.25(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 5-propan-2-yloxypyridine-3-carboxylate

Drug info:

PubChemData

Smile

C1CC(OC1)CCC(=O)NC2=C(N=CC=C2)Br

DOS

IR

Vibrations