Geometry & MOs

Info

ID:	235908
PubChem CID:	92711034
Reduced:	ClFO2N4H16C22 (1)
Stoich.:	ABC2D4E16F22 (1)
Weight, g/mol:	448.05349
ΔH_f, kcal/mol:	-8.04
Dipole, Da:	4.95
IP(EA), eV:	-9.16(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-bromophenyl)-3-[(R)-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)NC4=CC(=C(C=C4)F)Cl

DOS

IR

Vibrations