Geometry & MOs

Info

ID:	272587
PubChem CID:	103749225
Reduced:	FNO2C16H22 (1)
Stoich.:	ABC2D16E22 (1)
Weight, g/mol:	269.142722
ΔH_f, kcal/mol:	-103.19
Dipole, Da:	5.09
IP(EA), eV:	-8.97(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-fluoro-4-[[2-hydroxyethyl(propyl)amino]methyl]benzoate

Drug info:

PubChemData

Smile

CC(C)N(CC1CC1)CC2=CC(=C(C=C2)C(=O)OC)F

DOS

IR

Vibrations