Geometry & MOs

Info

ID:	56020
PubChem CID:	17403780
Reduced:	S2N3O4H15C16 (1)
Stoich.:	A2B3C4D15E16 (1)
Weight, g/mol:	323.126991
ΔH_f, kcal/mol:	-49.81
Dipole, Da:	11.59
IP(EA), eV:	-9.44(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(4-methoxyanilino)phenyl]-3-methyl-1,2-oxazole-5-carboxamide

Drug info:

PubChemData

Smile

CCC1=NN=C(S1)NC(=O)C2=CC=C(O2)CS(=O)(=O)C3=CC=CC=C3

DOS

IR

Vibrations