Geometry & MOs

Info

ID:	185540
PubChem CID:	77311868
Reduced:	BrO5N6C23H23 (1)
Stoich.:	AB5C6D23E23 (1)
Weight, g/mol:	551.06044
ΔH_f, kcal/mol:	-93.49
Dipole, Da:	4.96
IP(EA), eV:	-8.54(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-bromo-2-(5-oxo-1,2,4-oxadiazolidin-3-yl)phenyl]-7-[[2-(4-fluorophenyl)acetyl]amino]-1H-indole-2-carboxamide

Drug info:

PubChemData

Smile

CN1C(=CC2=C1C(=CC=C2)NC(=O)N3CCOCC3)C(=O)NC4=C(C=C(C=C4)Br)C5NC(=O)ON5

DOS

IR

Vibrations