Geometry & MOs

Info

ID:	251453
PubChem CID:	103104049
Reduced:	FN2O2C14H17 (1)
Stoich.:	AB2C2D14E17 (1)
Weight, g/mol:	278.143056
ΔH_f, kcal/mol:	-80.58
Dipole, Da:	3.98
IP(EA), eV:	-9.33(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[ethyl-[[4-fluoro-2-(4-hydroxybut-1-ynyl)phenyl]methyl]amino]acetamide

Drug info:

PubChemData

Smile

CCN(CC1=C(C=C(C=C1)C#CCO)F)CC(=O)N

DOS

IR

Vibrations