Geometry & MOs

Info

ID:	212748
PubChem CID:	81061707
Reduced:	NO4C14H19 (1)
Stoich.:	AB4C14D19 (1)
Weight, g/mol:	265.147807
ΔH_f, kcal/mol:	-155.04
Dipole, Da:	4.05
IP(EA), eV:	-9.59(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-[[2-ethoxyethyl(methyl)amino]methyl]-5-fluorophenyl]prop-2-yn-1-ol

Drug info:

PubChemData

Smile

CC(C)OCCN(C)C(=O)C1=CC(=CC=C1)C(=O)O

DOS

IR

Vibrations