Geometry & MOs

Info

ID:	319359
PubChem CID:	126655763
Reduced:	SN2O3C21H26 (1)
Stoich.:	AB2C3D21E26 (1)
Weight, g/mol:	351.219829
ΔH_f, kcal/mol:	-82.09
Dipole, Da:	5.8
IP(EA), eV:	-9.22(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,7-ditert-butyl-2-(4-methoxy-2-methylphenyl)-1,3-benzoxazole

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC(=C2C(=C1)N=C(O2)C3=CC=C(C=C3)S(=O)(=O)N)C(C)(C)C

DOS

IR

Vibrations