Geometry & MOs

Info

ID:	440762
PubChem CID:	135231332
Reduced:	ON2F3C13H17 (1)
Stoich.:	AB2C3D13E17 (1)
Weight, g/mol:	401.119798
ΔH_f, kcal/mol:	-169.54
Dipole, Da:	2.35
IP(EA), eV:	-9.81(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,3-oxazol-5-ylmethyl)-3-[4-(3-phenylphenyl)sulfanylphenyl]urea

Drug info:

PubChemData

Smile

CC(C)(C)C1=CN=C(N=C1OCC(F)(F)F)C2CC2

DOS

IR

Vibrations