Geometry & MOs

Info

ID:	150319
PubChem CID:	53790007
Reduced:	OCl2N4C26H28 (1)
Stoich.:	AB2C4D26E28 (1)
Weight, g/mol:	157.146664
ΔH_f, kcal/mol:	6.81
Dipole, Da:	5.11
IP(EA), eV:	-8.7(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-methoxyethyl)-3-methylpiperidine

Drug info:

PubChemData

Smile

CC(C1=CC=C(C=C1)Cl)C(C2CCNCC2)NC3=CC=CC=C3C(=O)NC4=NC=C(C=C4)Cl

DOS

IR

Vibrations