Geometry & MOs

Info

ID:	167653
PubChem CID:	74852835
Reduced:	ClN3O3C25H28 (1)
Stoich.:	AB3C3D25E28 (1)
Weight, g/mol:	330.115047
ΔH_f, kcal/mol:	-49.9
Dipole, Da:	2.42
IP(EA), eV:	-8.36(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(3-methyl-1,3-benzothiazol-2-ylidene)amino]propanamide

Drug info:

PubChemData

Smile

CC(C)COC1=C(C=C(C=C1)C=CC(=O)NC(C2=CC=C(C=C2)Cl)C3=NC=CN3C)OC

DOS

IR

Vibrations