Geometry & MOs

Info

ID:	293860
PubChem CID:	117406785
Reduced:	NF2O3C12H17 (1)
Stoich.:	AB2C3D12E17 (1)
Weight, g/mol:	261.116507
ΔH_f, kcal/mol:	-212.47
Dipole, Da:	2.49
IP(EA), eV:	-9.16(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(cyclobutylmethoxy)-2-fluoro-4-(1-isocyanatocyclopropyl)benzene

Drug info:

PubChemData

Smile

CNCC(C1=CC(=C(C=C1OC)OC)C(F)F)O

DOS

IR

Vibrations