Geometry & MOs

Info

ID:	60366
PubChem CID:	26683924
Reduced:	NO5H23C24 (1)
Stoich.:	AB5C23D24 (1)
Weight, g/mol:	454.093164
ΔH_f, kcal/mol:	-133.85
Dipole, Da:	4.81
IP(EA), eV:	-8.6(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(2-chloro-5-nitrobenzoyl)amino]phenyl] 2-(2,3-dimethylphenoxy)acetate

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)OCC(=O)OC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3OC)C

DOS

IR

Vibrations