Geometry & MOs

Info

ID:	143800
PubChem CID:	53265706
Reduced:	ON2C9H10 (3)
Stoich.:	AB2C9D10 (3)
Weight, g/mol:	383.209658
ΔH_f, kcal/mol:	32.39
Dipole, Da:	2.58
IP(EA), eV:	-8.62(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

hexyl 4-[2-(4-methylphenoxy)propanoylamino]benzoate

Drug info:

PubChemData

Smile

CCCCCCN1C2=CC=CC=C2C3=C1N=C(N=N3)N/N=C/C4=CC(=C(C=C4)OC(=O)C5CC5)OC

DOS

IR

Vibrations