Geometry & MOs

Info

ID:	183168
PubChem CID:	76985768
Reduced:	ON3C15H25 (1)
Stoich.:	AB3C15D25 (1)
Weight, g/mol:	291.070531
ΔH_f, kcal/mol:	-24.11
Dipole, Da:	3.06
IP(EA), eV:	-8.4(0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2,4-dichloro-5-fluorophenyl)-N-propan-2-ylpyrazolidin-3-amine

Drug info:

PubChemData

Smile

CC(C)NC1CC(NN1)C2=CC=C(C=C2)OC(C)C

DOS

IR

Vibrations