Geometry & MOs

Info

ID:	35425
PubChem CID:	7979844
Reduced:	ClN2O4H17C18 (1)
Stoich.:	AB2C4D17E18 (1)
Weight, g/mol:	244.025084
ΔH_f, kcal/mol:	-87.82
Dipole, Da:	1.08
IP(EA), eV:	-9.06(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-chloro-2-nitrophenoxy)-N-methylacetamide

Drug info:

PubChemData

Smile

COC1=CC(=CC(=C1)C(=O)NNC(=O)/C=C/C2=CC=CC=C2Cl)OC

DOS

IR

Vibrations