Geometry & MOs

Info

ID:	292351
PubChem CID:	114917312
Reduced:	OCl2N3C13H17 (1)
Stoich.:	AB2C3D13E17 (1)
Weight, g/mol:	330.053798
ΔH_f, kcal/mol:	-23.8
Dipole, Da:	5.9
IP(EA), eV:	-9.04(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 1-(2,5-dichloropyridine-4-carbonyl)piperidine-2-carboxylate

Drug info:

PubChemData

Smile

CN(C)C1CCN(CC1)C(=O)C2=CC(=NC=C2Cl)Cl

DOS

IR

Vibrations