Geometry & MOs

Info

ID:	185537
PubChem CID:	77311491
Reduced:	BrN5O6H20C22 (1)
Stoich.:	AB5C6D20E22 (1)
Weight, g/mol:	469.115296
ΔH_f, kcal/mol:	-151.48
Dipole, Da:	3.88
IP(EA), eV:	-8.59(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-chloro-2-(5-oxo-1,2,4-oxadiazolidin-3-yl)phenyl]-7-(oxolane-3-carbonylamino)-1H-indole-2-carboxamide

Drug info:

PubChemData

Smile

CC(=O)OCC(=O)NC1=CC2=C(C=C1)C=C(N2C)C(=O)NC3=C(C=C(C=C3)Br)C4NC(=O)ON4

DOS

IR

Vibrations