Geometry & MOs

Info

ID:	235953
PubChem CID:	92711142
Reduced:	FN3O3H18C23 (1)
Stoich.:	AB3C3D18E23 (1)
Weight, g/mol:	432.135304
ΔH_f, kcal/mol:	-38.09
Dipole, Da:	2.55
IP(EA), eV:	-9.16(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(S)-[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl]-phenylmethyl]-3-(2,4-dimethylphenyl)urea

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)C(=O)N[C@@H](C2=CC=CC=C2F)C3=NN=C(O3)C4=CC=CC=C4

DOS

IR

Vibrations