Geometry & MOs

Info

ID:	137159
PubChem CID:	52162081
Reduced:	SN2O2C10H10 (1)
Stoich.:	AB2C2D10E10 (1)
Weight, g/mol:	273.172879
ΔH_f, kcal/mol:	-65.96
Dipole, Da:	1.67
IP(EA), eV:	-8.73(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-tert-butyl-2-[(4-propan-2-ylphenoxy)methyl]-1,3-oxazole

Drug info:

PubChemData

Smile

C[C@@]1(C(=O)NC2=CC=CC=C2S1)C(=O)N

DOS

IR

Vibrations