Geometry & MOs

Info

ID:	276359
PubChem CID:	103822427
Reduced:	O2N3C11H11 (1)
Stoich.:	A2B3C11D11 (1)
Weight, g/mol:	274.052447
ΔH_f, kcal/mol:	28.97
Dipole, Da:	3.53
IP(EA), eV:	-9.2(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[5-[2-(aminomethyl)-1,3-thiazol-4-yl]-1,2,4-oxadiazol-3-yl]phenol

Drug info:

PubChemData

Smile

C1CC1(C2=NC(=NO2)C3=CC(=CC=C3)O)N

DOS

IR

Vibrations