Geometry & MOs

Info

ID:	182606
PubChem CID:	76913590
Reduced:	ClFN3C13H19 (1)
Stoich.:	ABC3D13E19 (1)
Weight, g/mol:	287.095603
ΔH_f, kcal/mol:	-30.85
Dipole, Da:	4.14
IP(EA), eV:	-8.64(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2,6-dichlorophenyl)-4-(2-methylpropyl)pyrazolidin-3-amine

Drug info:

PubChemData

Smile

CC(C)CC1C(NNC1N)C2=C(C=CC=C2Cl)F

DOS

IR

Vibrations