Geometry & MOs

Info

ID:	78361
PubChem CID:	49689081
Reduced:	Cl2N2O3C20H20 (1)
Stoich.:	A2B2C3D20E20 (1)
Weight, g/mol:	410.220557
ΔH_f, kcal/mol:	-99.27
Dipole, Da:	4.83
IP(EA), eV:	-9.11(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

phenyl 4-[[[2-(4-propan-2-ylphenoxy)acetyl]amino]methyl]piperidine-1-carboxylate

Drug info:

PubChemData

Smile

C1CN(CCC1CNC(=O)C2=CC(=C(C=C2)Cl)Cl)C(=O)OC3=CC=CC=C3

DOS

IR

Vibrations