Geometry & MOs

Info

ID:	131347
PubChem CID:	51194104
Reduced:	N2O3C18H22 (1)
Stoich.:	A2B3C18D22 (1)
Weight, g/mol:	315.02185
ΔH_f, kcal/mol:	-83.01
Dipole, Da:	6.97
IP(EA), eV:	-9.52(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-bromo-2-nitroanilino)-N-ethylpropanamide

Drug info:

PubChemData

Smile

CC(C)CC(C1=CC=CC=C1)NC(=O)CNC(=O)C2=CC=CO2

DOS

IR

Vibrations