Geometry & MOs

Info

ID:	280589
PubChem CID:	103850045
Reduced:	FNO3C14H18 (1)
Stoich.:	ABC3D14E18 (1)
Weight, g/mol:	222.105608
ΔH_f, kcal/mol:	-150.49
Dipole, Da:	1.65
IP(EA), eV:	-9.72(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(cyclopentylmethoxy)-3-fluorobenzaldehyde

Drug info:

PubChemData

Smile

CCC(CC)NC(=O)COC1=C(C=C(C=C1)C=O)F

DOS

IR

Vibrations