Geometry & MOs

Info

ID:	68145
PubChem CID:	46507831
Reduced:	BrOSN3H8C12 (1)
Stoich.:	ABCD3E8F12 (1)
Weight, g/mol:	333.147727
ΔH_f, kcal/mol:	50.43
Dipole, Da:	3.95
IP(EA), eV:	-9.18(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dihydro-1H-inden-5-yl)-2-(3-methyl-2-oxoquinoxalin-1-yl)acetamide

Drug info:

PubChemData

Smile

C1C(=NC2=C(NC1=O)N=CC=C2)C3=CC=C(S3)Br

DOS

IR

Vibrations