Geometry & MOs

Info

ID:	286005
PubChem CID:	104145076
Reduced:	ON5C15H21 (1)
Stoich.:	AB5C15D21 (1)
Weight, g/mol:	287.17461
ΔH_f, kcal/mol:	5.15
Dipole, Da:	3.04
IP(EA), eV:	-8.77(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations