Geometry & MOs

Info

ID:	390484
PubChem CID:	134999387
Reduced:	OSN2C12H14 (1)
Stoich.:	ABC2D12E14 (1)
Weight, g/mol:	347.076928
ΔH_f, kcal/mol:	7.45
Dipole, Da:	2.49
IP(EA), eV:	-8.74(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(4-methoxyphenyl)-1,2-oxazol-4-yl]-[4-(trifluoromethyl)phenyl]methanone

Drug info:

PubChemData

Smile

C1COCCN1C2N=CC3=CC=CC=C3S2

DOS

IR

Vibrations