Geometry & MOs

Info

ID:	286003
PubChem CID:	104145068
Reduced:	OSN3C15H19 (1)
Stoich.:	ABC3D15E19 (1)
Weight, g/mol:	259.14331
ΔH_f, kcal/mol:	5.87
Dipole, Da:	2.75
IP(EA), eV:	-8.79(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC1=NC(=CC(=C1)C(=O)N(C)CC2=CSC=C2)NC

DOS

IR

Vibrations