Geometry & MOs

Info

ID:	212770
PubChem CID:	81061809
Reduced:	NO2C13H27 (1)
Stoich.:	AB2C13D27 (1)
Weight, g/mol:	279.127072
ΔH_f, kcal/mol:	-122.81
Dipole, Da:	1.94
IP(EA), eV:	-8.79(1.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-ethoxyethyl)-3-fluoro-4-(3-hydroxyprop-1-ynyl)-N-methylbenzamide

Drug info:

PubChemData

Smile

CCOCCN(C)C1CCCC(C1O)(C)C

DOS

IR

Vibrations