Geometry & MOs

Info

ID:	30874
PubChem CID:	842091
Reduced:	N3O3C16H19 (1)
Stoich.:	A3B3C16D19 (1)
Weight, g/mol:	280.084792
ΔH_f, kcal/mol:	-32.78
Dipole, Da:	4.52
IP(EA), eV:	-8.42(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

pyridin-3-yl 5-methyl-3-phenyl-1,2-oxazole-4-carboxylate

Drug info:

PubChemData

Smile

CC1=CC(=NO1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)OC

DOS

IR

Vibrations