Geometry & MOs

Info

ID:	427897
PubChem CID:	135165033
Reduced:	NO2C21H41 (1)
Stoich.:	AB2C21D41 (1)
Weight, g/mol:	349.272927
ΔH_f, kcal/mol:	-154.02
Dipole, Da:	2.45
IP(EA), eV:	-8.46(2.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-[(2-methylpropan-2-yl)oxy]propyl]-4-[6-[(2-methylpropan-2-yl)oxy]pyridin-3-yl]piperazine

Drug info:

PubChemData

Smile

CC(CC1CCN(CC1)CC2CC(C2)OC(C)(C)C)OC(C)(C)C

DOS

IR

Vibrations