Geometry & MOs

Info

ID:	48574
PubChem CID:	11108679
Reduced:	ClN2O2C14H15 (1)
Stoich.:	AB2C2D14E15 (1)
Weight, g/mol:	279.147058
ΔH_f, kcal/mol:	10.83
Dipole, Da:	2.83
IP(EA), eV:	-9.52(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-methyl-3-(2-morpholin-4-ylethoxy)benzoate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CON2C(=CC=N2)C(=O)CCCCl

DOS

IR

Vibrations