Geometry & MOs

Info

ID:	260615
PubChem CID:	103197484
Reduced:	ClON3C12H14 (1)
Stoich.:	ABC3D12E14 (1)
Weight, g/mol:	284.184841
ΔH_f, kcal/mol:	-13.56
Dipole, Da:	2.99
IP(EA), eV:	-9.47(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(N'-hydroxycarbamimidoyl)-2-methylbutanoyl]-N-methylpiperidine-3-carboxamide

Drug info:

PubChemData

Smile

C1CC2C(CNC2=O)N(C1)C3=CC(=NC=C3)Cl

DOS

IR

Vibrations