Geometry & MOs

Info

ID:	188567
PubChem CID:	77735476
Reduced:	BrON8H17C18 (1)
Stoich.:	ABC8D17E18 (1)
Weight, g/mol:	591.11173
ΔH_f, kcal/mol:	133.67
Dipole, Da:	7.98
IP(EA), eV:	-8.49(-1.26)
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-[4-(4-methoxyphenyl)butanoylamino]-1H-indole-2-carboxamide

Drug info:

PubChemData

Smile

CN1C(=CC2=C(C=CC(=C21)N)Br)C(=O)NC3=C(C=C(C=C3)C#N)C4NNNN4

DOS

IR

Vibrations