Geometry & MOs

Info

ID:	155835
PubChem CID:	56367745
Reduced:	SBr2N2O2H16C17 (1)
Stoich.:	AB2C2D2E16F17 (1)
Weight, g/mol:	414.03275
ΔH_f, kcal/mol:	-45.76
Dipole, Da:	1.16
IP(EA), eV:	-9.06(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-acetamido-5-bromophenyl)-2-(2-oxoquinoxalin-1-yl)acetamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)Br)SCC(=O)NC2=C(C=CC(=C2)Br)NC(=O)C

DOS

IR

Vibrations