Geometry & MOs

Info

ID:	256527
PubChem CID:	103139716
Reduced:	ON3C17H17 (1)
Stoich.:	AB3C17D17 (1)
Weight, g/mol:	231.138992
ΔH_f, kcal/mol:	53.06
Dipole, Da:	1.52
IP(EA), eV:	-9.04(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(chloromethyl)-1-[(5-methyloxolan-2-yl)methyl]piperidine

Drug info:

PubChemData

Smile

COC1=CC=CC=C1C(C2=CC=CC3=C2C=NC=C3)NN

DOS

IR

Vibrations