Geometry & MOs

Info

ID:	264764
PubChem CID:	103489363
Reduced:	NO2C11H23 (1)
Stoich.:	AB2C11D23 (1)
Weight, g/mol:	271.121986
ΔH_f, kcal/mol:	-89.61
Dipole, Da:	2.78
IP(EA), eV:	-8.77(1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-amino-5-(1-ethoxypropan-2-yloxy)-4-fluorobenzoate

Drug info:

PubChemData

Smile

CCNCC(=C)COC(C)COCC

DOS

IR

Vibrations