Geometry & MOs

Info

ID:	29023
PubChem CID:	831183
Reduced:	BrO4H11C13 (1)
Stoich.:	AB4C11D13 (1)
Weight, g/mol:	298.131742
ΔH_f, kcal/mol:	-105.62
Dipole, Da:	4.18
IP(EA), eV:	-9.72(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-hydroxy-5-methylphenyl)methylideneamino]-2-(2-methylphenoxy)acetamide

Drug info:

PubChemData

Smile

CC(=O)C[C@H]1C(=C(C(=O)O1)OC2=CC=CC=C2)Br

DOS

IR

Vibrations