Geometry & MOs

Info

ID:	295942
PubChem CID:	117548228
Reduced:	ON2C11H22 (1)
Stoich.:	AB2C11D22 (1)
Weight, g/mol:	260.188863
ΔH_f, kcal/mol:	-38.36
Dipole, Da:	4.51
IP(EA), eV:	-8.71(2.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[3-(3-methylphenyl)oxetan-3-yl]ethyl]piperazine

Drug info:

PubChemData

Smile

CCCC1(COC1)CN2CCNCC2

DOS

IR

Vibrations