Geometry & MOs

Info

ID:	35331
PubChem CID:	7979712
Reduced:	ClN2O6C17H17 (1)
Stoich.:	AB2C6D17E17 (1)
Weight, g/mol:	364.046214
ΔH_f, kcal/mol:	-154.03
Dipole, Da:	2.0
IP(EA), eV:	-9.5(-1.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-chloro-2-nitrophenoxy)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(NC(=C1C)C(=O)COC2=C(C=C(C=C2)Cl)[N+](=O)[O-])C

DOS

IR

Vibrations