Geometry & MOs

Info

ID:	337361
PubChem CID:	127257046
Reduced:	N2O2F3C20H23 (1)
Stoich.:	A2B2C3D20E23 (1)
Weight, g/mol:	326.218113
ΔH_f, kcal/mol:	-194.11
Dipole, Da:	4.24
IP(EA), eV:	-8.98(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

pyrrolidin-3-amine;3,5,5-trimethylhexyl 2,2,2-trifluoroacetate

Drug info:

PubChemData

Smile

C1CNCC1N.C1=CC=C(C=C1)C(COC(=O)C(F)(F)F)C2=CC=CC=C2

DOS

IR

Vibrations