Geometry & MOs

Info

ID:	156855
PubChem CID:	56394749
Reduced:	N3O6C26H37 (1)
Stoich.:	A3B6C26D37 (1)
Weight, g/mol:	459.123084
ΔH_f, kcal/mol:	-264.37
Dipole, Da:	2.99
IP(EA), eV:	-8.81(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 1-[2-[[4-chloro-3-(methanesulfonamido)benzoyl]-methylamino]acetyl]piperidine-4-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1CCN(CC1)C(=O)CN(C)C(=O)C2CCN(CC2)C(=O)CCOC3=CC=CC=C3

DOS

IR

Vibrations