Geometry & MOs

Info

ID:	137440
PubChem CID:	52208709
Reduced:	O2N3H17C18 (1)
Stoich.:	A2B3C17D18 (1)
Weight, g/mol:	294.218152
ΔH_f, kcal/mol:	-17.98
Dipole, Da:	2.85
IP(EA), eV:	-8.48(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

1-[2-[cyclopenten-1-yl(ethyl)amino]-2-oxoethyl]-N-methylpiperidin-1-ium-4-carboxamide

Drug info:

PubChemData

Smile

C1C[C@@H](OC1)C2=NC3=C(N2)C=C(C=C3)NC(=O)C4=CC=CC=C4

DOS

IR

Vibrations