Geometry & MOs

Info

ID:	280608
PubChem CID:	103850166
Reduced:	ON2C4H6 (2)
Stoich.:	AB2C4D6 (2)
Weight, g/mol:	254.095437
ΔH_f, kcal/mol:	-41.38
Dipole, Da:	2.6
IP(EA), eV:	-9.15(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

butyl 2-(2-fluoro-4-formylphenoxy)acetate

Drug info:

PubChemData

Smile

CC1=NC(=NN1)NC(=O)[C@H]2CCCO2

DOS

IR

Vibrations