Geometry & MOs

Info

ID:	314885
PubChem CID:	126623892
Reduced:	FN4O4C11H18 (1)
Stoich.:	AB4C4D11E18 (1)
Weight, g/mol:	287.115558
ΔH_f, kcal/mol:	-177.88
Dipole, Da:	8.94
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.792914
Charge, e:	-1

Chem-info

IUPAC name:

4-(azidomethyl)-4-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CC(CC1C(=O)O)(CN=[N+]=N)F

DOS

IR

Vibrations