Geometry & MOs

Info

ID:	35332
PubChem CID:	7979713
Reduced:	ClN2O6H13C16 (1)
Stoich.:	AB2C6D13E16 (1)
Weight, g/mol:	365.041463
ΔH_f, kcal/mol:	-114.33
Dipole, Da:	3.35
IP(EA), eV:	-8.65(-1.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-chloro-2-nitrophenoxy)-N-(2-methyl-5-nitrophenyl)acetamide

Drug info:

PubChemData

Smile

C1COC2=C(O1)C=CC(=C2)NC(=O)COC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

DOS

IR

Vibrations