Geometry & MOs

Info

ID:	177576
PubChem CID:	76201192
Reduced:	ON3C20H27 (1)
Stoich.:	AB3C20D27 (1)
Weight, g/mol:	311.199762
ΔH_f, kcal/mol:	2.9
Dipole, Da:	2.69
IP(EA), eV:	-8.21(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[5-[4-(2-methylpropoxy)phenyl]pyrazolidin-3-yl]aniline

Drug info:

PubChemData

Smile

CC(C)CCOC1=CC=CC(=C1)C2CC(NN2)C3=CC=C(C=C3)N

DOS

IR

Vibrations