Geometry & MOs

Info

ID:	280956
PubChem CID:	103852157
Reduced:	BrClNOC13H13 (1)
Stoich.:	ABCDE13F13 (1)
Weight, g/mol:	213.136493
ΔH_f, kcal/mol:	-20.36
Dipole, Da:	5.03
IP(EA), eV:	-9.29(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methoxyethoxy)-1-(4-methyl-3,6-dihydro-2H-pyridin-1-yl)ethanone

Drug info:

PubChemData

Smile

CC1=CCN(CC1)C(=O)C2=C(C=CC(=C2)Cl)Br

DOS

IR

Vibrations