Geometry & MOs

Info

ID:	30984
PubChem CID:	854039
Reduced:	O2N3C7H7 (1)
Stoich.:	A2B3C7D7 (1)
Weight, g/mol:	209.024356
ΔH_f, kcal/mol:	-48.96
Dipole, Da:	2.2
IP(EA), eV:	-10.62(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-5-methyl-2-(1,2-oxazol-5-yl)phenol

Drug info:

PubChemData

Smile

C1=CC(=NC(=C1)C(=O)N)C(=O)N

DOS

IR

Vibrations