Geometry & MOs

Info

ID:	426043
PubChem CID:	135135408
Reduced:	FNC5H7 (2)
Stoich.:	ABC5D7 (2)
Weight, g/mol:	290.199428
ΔH_f, kcal/mol:	-75.57
Dipole, Da:	4.13
IP(EA), eV:	-8.68(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3-[(2,6-dimethylpyridin-4-yl)methyl]pyrrolidine-1-carboxylate

Drug info:

PubChemData

Smile

C1CNCC1CC2=C(C=C(CN2)F)F

DOS

IR

Vibrations