Geometry & MOs

Info

ID:	209724
PubChem CID:	80708998
Reduced:	BrNF2O2C13H16 (1)
Stoich.:	ABC2D2E13F16 (1)
Weight, g/mol:	273.194008
ΔH_f, kcal/mol:	-162.5
Dipole, Da:	5.31
IP(EA), eV:	-9.51(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (2R)-1-[2-(2-methoxyethoxy)ethyl]pyrrolidine-2-carboxylate

Drug info:

PubChemData

Smile

CC(C)OCCN(C)C(=O)C1=C(C=C(C=C1F)Br)F

DOS

IR

Vibrations