Geometry & MOs

Info

ID:	343048
PubChem CID:	127266221
Reduced:	N3O3C19H23 (1)
Stoich.:	A3B3C19D23 (1)
Weight, g/mol:	245.062283
ΔH_f, kcal/mol:	-107.32
Dipole, Da:	4.46
IP(EA), eV:	-9.14(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]-2-oxopyridine-4-carbonitrile

Drug info:

PubChemData

Smile

CN(C)C(=O)C1=CN(C(=O)C2=CC=CC=C21)CC(=O)NC3CCCC3

DOS

IR

Vibrations