Geometry & MOs

Info

ID:	286388
PubChem CID:	104170095
Reduced:	ON2C13H28 (1)
Stoich.:	AB2C13D28 (1)
Weight, g/mol:	242.235814
ΔH_f, kcal/mol:	-73.78
Dipole, Da:	1.77
IP(EA), eV:	-8.42(2.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-butan-2-yl-5-ethyl-1-(2-methoxypropyl)piperazine

Drug info:

PubChemData

Smile

CCC1CN(C(CN1)C(C)C)CC(C)OC

DOS

IR

Vibrations