Geometry & MOs

Info

ID:	280611
PubChem CID:	103850173
Reduced:	FN2O3H9C11 (1)
Stoich.:	AB2C3D9E11 (1)
Weight, g/mol:	192.058658
ΔH_f, kcal/mol:	-37.39
Dipole, Da:	2.55
IP(EA), eV:	-9.84(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-but-2-ynoxy-3-fluorobenzaldehyde

Drug info:

PubChemData

Smile

CC1=NON=C1COC2=C(C=C(C=C2)C=O)F

DOS

IR

Vibrations