Geometry & MOs

Info

ID:	145098
PubChem CID:	53460860
Reduced:	O2N4C17H22 (1)
Stoich.:	A2B4C17D22 (1)
Weight, g/mol:	389.09641
ΔH_f, kcal/mol:	-0.36
Dipole, Da:	3.76
IP(EA), eV:	-8.47(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3-tert-butyl-4-ethoxyphenyl)-4-iodopyrazolidin-3-amine

Drug info:

PubChemData

Smile

COC1=CC=CC=C1C=CC=NNC(=O)C2C3CCCC3NN2

DOS

IR

Vibrations