Geometry & MOs

Info

ID:	358829
PubChem CID:	127296697
Reduced:	OCl2N4C18H20 (1)
Stoich.:	AB2C4D18E20 (1)
Weight, g/mol:	236.188863
ΔH_f, kcal/mol:	17.87
Dipole, Da:	6.89
IP(EA), eV:	-9.31(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-ethylpiperidin-2-yl)-(4-methylidenepiperidin-1-yl)methanone

Drug info:

PubChemData

Smile

CC(C)C1=NC(=NN1C2=C(C=CC=C2Cl)Cl)C(=O)N3CCC(=C)CC3

DOS

IR

Vibrations