Geometry & MOs

Info

ID:	444837
PubChem CID:	135263685
Reduced:	NO2C14H19 (1)
Stoich.:	AB2C14D19 (1)
Weight, g/mol:	368.246378
ΔH_f, kcal/mol:	-62.84
Dipole, Da:	7.66
IP(EA), eV:	-10.06(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-tert-butyl-4-[2-(4-phenylmethoxyphenoxy)ethyl]piperazine

Drug info:

PubChemData

Smile

C[C@H]1CC[C@@]2(C=C(C(=O)C([C@H]2O1)(C)C)C#N)C

DOS

IR

Vibrations