Geometry & MOs

Info

ID:	141628
PubChem CID:	52903861
Reduced:	SN2O3H7C10 (1)
Stoich.:	AB2C3D7E10 (1)
Weight, g/mol:	366.157957
ΔH_f, kcal/mol:	-44.6
Dipole, Da:	3.21
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.767710
Charge, e:	0

Chem-info

IUPAC name:

N-(4-ethoxyphenyl)-5-(4-propan-2-yloxyphenyl)-1,2-oxazole-3-carboxamide

Drug info:

PubChemData

Smile

C1=CSC(=C1)C2=CC(=O)N(C=N2)CC(=O)[O-]

DOS

IR

Vibrations