Geometry & MOs

Info

ID:	182875
PubChem CID:	76948481
Reduced:	NO2F3H10C15 (1)
Stoich.:	AB2C3D10E15 (1)
Weight, g/mol:	219.173548
ΔH_f, kcal/mol:	-102.38
Dipole, Da:	6.72
IP(EA), eV:	-10.04(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-methylpyrazolidin-4-yl)-3-phenylpropan-2-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=CC2=CC=CC=C2C(F)(F)F)[N+](=O)[O-]

DOS

IR

Vibrations