Geometry & MOs

Info

ID:	286007
PubChem CID:	104145082
Reduced:	ON5C14H19 (1)
Stoich.:	AB5C14D19 (1)
Weight, g/mol:	273.15896
ΔH_f, kcal/mol:	9.81
Dipole, Da:	3.05
IP(EA), eV:	-8.73(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-tert-butyl-6-(methylamino)-N-(1H-pyrazol-4-yl)pyridine-4-carboxamide

Drug info:

PubChemData

Smile

CCCC1=NC(=CC(=C1)C(=O)NC2=CNN=C2)NCC

DOS

IR

Vibrations