Geometry & MOs

Info

ID:	182905
PubChem CID:	76953283
Reduced:	N3O3C14H21 (1)
Stoich.:	A3B3C14D21 (1)
Weight, g/mol:	277.215413
ΔH_f, kcal/mol:	-93.39
Dipole, Da:	3.16
IP(EA), eV:	-8.82(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-methoxy-4-methylphenyl)-5-(2-methylbutan-2-yl)pyrazolidin-3-amine

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N(CCC(=NO)N)C1=CC=CC=C1

DOS

IR

Vibrations