Geometry & MOs

Info

ID:	285871
PubChem CID:	104134121
Reduced:	ClN2O2C13H19 (1)
Stoich.:	AB2C2D13E19 (1)
Weight, g/mol:	256.097855
ΔH_f, kcal/mol:	-93.6
Dipole, Da:	4.47
IP(EA), eV:	-9.9(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-6-ethyl-N-(1-hydroxy-2-methylpropan-2-yl)pyridine-4-carboxamide

Drug info:

PubChemData

Smile

CCCC1=NC(=CC(=C1)C(=O)NC(CC)CO)Cl

DOS

IR

Vibrations