Geometry & MOs

Info

ID:	23096
PubChem CID:	601839
Reduced:	NF3O3C12H18 (1)
Stoich.:	AB3C3D12E18 (1)
Weight, g/mol:	281.123878
ΔH_f, kcal/mol:	-309.8
Dipole, Da:	5.73
IP(EA), eV:	-10.12(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

butan-2-yl 3-methyl-1-(2,2,2-trifluoroacetyl)pyrrolidine-2-carboxylate

Drug info:

PubChemData

Smile

CCC(C)OC(=O)C1C(CCN1C(=O)C(F)(F)F)C

DOS

IR

Vibrations