Geometry & MOs

Info

ID:	340924
PubChem CID:	127263359
Reduced:	NOC4H6 (2)
Stoich.:	ABC4D6 (2)
Weight, g/mol:	298.10842
ΔH_f, kcal/mol:	-44.21
Dipole, Da:	3.48
IP(EA), eV:	-10.5(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3-(2-chloropyridin-4-yl)oxypyrrolidine-1-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(C(N=N1)C)C

DOS

IR

Vibrations