Geometry & MOs

Info

ID:	194466
PubChem CID:	78540961
Reduced:	N3O4C20H23 (1)
Stoich.:	A3B4C20D23 (1)
Weight, g/mol:	387.134969
ΔH_f, kcal/mol:	-49.44
Dipole, Da:	4.19
IP(EA), eV:	-8.26(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-oxo-1-(4-piperidin-1-ylanilino)propan-2-yl] 2-chloropyridine-3-carboxylate

Drug info:

PubChemData

Smile

CC(C(=O)NC1=CC=C(C=C1)N2CCCCC2)OC3=CC=CC(=C3)[N+](=O)[O-]

DOS

IR

Vibrations