Geometry & MOs

Info

ID:	156781
PubChem CID:	56385600
Reduced:	SN5O6C22H25 (1)
Stoich.:	AB5C6D22E25 (1)
Weight, g/mol:	379.116821
ΔH_f, kcal/mol:	-108.87
Dipole, Da:	3.71
IP(EA), eV:	-8.82(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3,4-dimethoxyphenyl)-4-[(2-phenyl-1,3-oxazol-4-yl)methyl]-1,2,4-oxadiazol-5-one

Drug info:

PubChemData

Smile

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CN3C(=NOC3=O)C4=CC(=C(C=C4)OC)OC

DOS

IR

Vibrations