Geometry & MOs

Info

ID:	177624
PubChem CID:	76204371
Reduced:	ClFNO3C13H13 (1)
Stoich.:	ABCD3E13F13 (1)
Weight, g/mol:	253.15904
ΔH_f, kcal/mol:	-154.43
Dipole, Da:	2.44
IP(EA), eV:	-9.76(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2-ethoxyethyl)-4-(2-fluorophenyl)pyrazolidin-3-amine

Drug info:

PubChemData

Smile

CCOC(=O)CNC(=O)C=CC1=CC(=C(C=C1)F)Cl

DOS

IR

Vibrations