Geometry & MOs

Info

ID:	285879
PubChem CID:	104134682
Reduced:	ClN2O2C11H13 (1)
Stoich.:	AB2C2D11E13 (1)
Weight, g/mol:	312.160456
ΔH_f, kcal/mol:	-76.38
Dipole, Da:	6.24
IP(EA), eV:	-10.14(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-tert-butyl-6-chloro-N-(1-hydroxy-4-methylpentan-2-yl)pyridine-4-carboxamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations