Geometry & MOs

Info

ID:	183171
PubChem CID:	76985885
Reduced:	N3C16H21 (1)
Stoich.:	A3B16C21 (1)
Weight, g/mol:	235.168462
ΔH_f, kcal/mol:	54.09
Dipole, Da:	3.38
IP(EA), eV:	-8.63(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-5-(2-methoxy-5-methylphenyl)pyrazolidin-3-amine

Drug info:

PubChemData

Smile

CCCNC1CC(NN1)C2=CC=CC3=CC=CC=C32

DOS

IR

Vibrations