Geometry & MOs

Info

ID:	168864
PubChem CID:	75029848
Reduced:	ClO2N3H28C31 (1)
Stoich.:	AB2C3D28E31 (1)
Weight, g/mol:	181.082721
ΔH_f, kcal/mol:	0.99
Dipole, Da:	5.32
IP(EA), eV:	-8.33(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

sodium;N-(2-methylpiperidin-1-yl)-N-oxidonitrous amide

Drug info:

PubChemData

Smile

C1CC2C(C3(CCC4C(C3=O)NC5=CC=CC=C45)C6(N2C1)C7=CC=CC=C7NC6=O)C8=CC=C(C=C8)Cl

DOS

IR

Vibrations