Geometry & MOs

Info

ID:	29916
PubChem CID:	838202
Reduced:	NO5C19H21 (1)
Stoich.:	AB5C19D21 (1)
Weight, g/mol:	347.092436
ΔH_f, kcal/mol:	-184.39
Dipole, Da:	2.1
IP(EA), eV:	-8.81(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-chloro-3-[[2-(2,6-dimethylphenoxy)acetyl]amino]benzoate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(C=CC(=C1)NC(=O)COC2=C(C=CC=C2C)C)O

DOS

IR

Vibrations