Geometry & MOs

Info

ID:	121332
PubChem CID:	50763778
Reduced:	SO4N5H21C25 (1)
Stoich.:	AB4C5D21E25 (1)
Weight, g/mol:	468.120047
ΔH_f, kcal/mol:	-21.22
Dipole, Da:	9.18
IP(EA), eV:	-8.82(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(2,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl 1-(4-chlorophenyl)-5-methyltriazole-4-carboxylate

Drug info:

PubChemData

Smile

COC1=CC=CC=C1NC(=O)CSC2=NC(=O)C(=NN2)C3=CC=CC=C3NC(=O)C4=CC=CC=C4

DOS

IR

Vibrations