Geometry & MOs

Info

ID:	285889
PubChem CID:	104136057
Reduced:	ClN2O2C13H19 (1)
Stoich.:	AB2C2D13E19 (1)
Weight, g/mol:	284.129156
ΔH_f, kcal/mol:	-93.91
Dipole, Da:	4.16
IP(EA), eV:	-9.56(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-(2-hydroxy-2-methylpropyl)-N-methyl-6-propan-2-ylpyridine-4-carboxamide

Drug info:

PubChemData

Smile

CCC1=NC(=CC(=C1)C(=O)N(C)CC(C)(C)O)Cl

DOS

IR

Vibrations