Geometry & MOs

Info

ID:	277643
PubChem CID:	103830069
Reduced:	FO2N3C14H16 (1)
Stoich.:	AB2C3D14E16 (1)
Weight, g/mol:	221.085207
ΔH_f, kcal/mol:	-91.5
Dipole, Da:	2.68
IP(EA), eV:	-9.27(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-fluoro-2-hydroxy-N-pent-4-yn-2-ylbenzamide

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C)C)CNC(=O)C2=C(C=C(C=C2)F)O

DOS

IR

Vibrations