Geometry & MOs

Info

ID:	33170
PubChem CID:	7885261
Reduced:	NO2C7H9 (3)
Stoich.:	AB2C7D9 (3)
Weight, g/mol:	395.069114
ΔH_f, kcal/mol:	-258.88
Dipole, Da:	5.74
IP(EA), eV:	-9.44(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,6-dichlorophenoxy)ethyl 2-[(3,4-dimethylbenzoyl)amino]acetate

Drug info:

PubChemData

Smile

CC[C@H]1C(=C(NC(=O)N1)COC(=O)CNC(=O)C2=CC(=C(C=C2)C)C)C(=O)OCC

DOS

IR

Vibrations