Geometry & MOs

Info

ID:	444969
PubChem CID:	135264126
Reduced:	N4O4H40C41 (1)
Stoich.:	A4B4C40D41 (1)
Weight, g/mol:	248.036797
ΔH_f, kcal/mol:	-31.1
Dipole, Da:	10.22
IP(EA), eV:	-9.29(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4H-[1,2]oxazolo[4,5-c]pyridin-5-yl)-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

CC(C)C1=CC=C(C=C1)N(C(C2=CC=C(C=C2)/C=C/C(=O)O)C(=O)NC3CCCC3)C(=O)C4=NN(C(=C4)C5=CC=CC=C5)C6=CC=CC=C6

DOS

IR

Vibrations