Geometry & MOs

Info

ID:	235939
PubChem CID:	92711088
Reduced:	ClO2F3N4H16C23 (1)
Stoich.:	AB2C3D4E16F23 (1)
Weight, g/mol:	418.119654
ΔH_f, kcal/mol:	-123.65
Dipole, Da:	4.68
IP(EA), eV:	-9.51(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(S)-(4-chlorophenyl)-(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-3-(3-methylphenyl)urea

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=NN=C(O2)[C@@H](C3=CC=C(C=C3)Cl)NC(=O)NC4=CC=CC=C4C(F)(F)F

DOS

IR

Vibrations