Geometry & MOs

Info

ID:	59897
PubChem CID:	24902306
Reduced:	ClNOC10H12 (1)
Stoich.:	ABCD10E12 (1)
Weight, g/mol:	239.107692
ΔH_f, kcal/mol:	-14.45
Dipole, Da:	1.52
IP(EA), eV:	-8.89(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(4-chloro-2-methylphenoxy)methyl]piperidine

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)Cl)OC2CNC2

DOS

IR

Vibrations