Geometry & MOs

Info

ID:	256551
PubChem CID:	103139863
Reduced:	ClON2H15C17 (1)
Stoich.:	ABC2D15E17 (1)
Weight, g/mol:	289.10413
ΔH_f, kcal/mol:	11.44
Dipole, Da:	3.93
IP(EA), eV:	-8.38(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1Cl)C)OC2=C3C=NC=CC3=C(C=C2)N

DOS

IR

Vibrations