Geometry & MOs

Info

ID:	276417
PubChem CID:	103823171
Reduced:	ON7C10H15 (1)
Stoich.:	AB7C10D15 (1)
Weight, g/mol:	329.0375
ΔH_f, kcal/mol:	74.48
Dipole, Da:	7.14
IP(EA), eV:	-9.72(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-bromo-4-nitroanilino)-N,2,2-trimethylpropanamide

Drug info:

PubChemData

Smile

CC(C)(CNC1=NN2C(=NN=N2)C=C1)C(=O)NC

DOS

IR

Vibrations