Geometry & MOs

Info

ID:	295940
PubChem CID:	117548187
Reduced:	BrON2C13H17 (1)
Stoich.:	ABC2D13E17 (1)
Weight, g/mol:	262.168128
ΔH_f, kcal/mol:	11.93
Dipole, Da:	2.27
IP(EA), eV:	-9.07(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[3-(4-methoxyphenyl)oxetan-3-yl]methyl]piperazine

Drug info:

PubChemData

Smile

C1CN(CCN1)C2(COC2)C3=CC=C(C=C3)Br

DOS

IR

Vibrations