Geometry & MOs

Info

ID:	432272
PubChem CID:	135172404
Reduced:	NOC9H15 (2)
Stoich.:	ABC9D15 (2)
Weight, g/mol:	245.189198
ΔH_f, kcal/mol:	-82.9
Dipole, Da:	2.09
IP(EA), eV:	-8.51(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-methylazetidin-3-yl)-4-(4-methylphenyl)piperazine

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)OCCN2CCN(CC2)CCOC(C)C

DOS

IR

Vibrations