Geometry & MOs

Info

ID:	13314
PubChem CID:	225442
Reduced:	BrIN2O3H6C8 (1)
Stoich.:	ABC2D3E6F8 (1)
Weight, g/mol:	383.86065
ΔH_f, kcal/mol:	-12.56
Dipole, Da:	2.56
IP(EA), eV:	-9.59(-1.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-(4-iodo-2-nitrophenyl)acetamide

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1I)[N+](=O)[O-])NC(=O)CBr

DOS

IR

Vibrations