Geometry & MOs

Info

ID:	235932
PubChem CID:	92711078
Reduced:	FO2N4H19C23 (1)
Stoich.:	AB2C4D19E23 (1)
Weight, g/mol:	416.130697
ΔH_f, kcal/mol:	-2.7
Dipole, Da:	3.31
IP(EA), eV:	-9.63(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=NN=C(O2)[C@@H](C3=CC=CC=C3)NC(=O)NCC4=CC=C(C=C4)F

DOS

IR

Vibrations