Geometry & MOs

Info

ID:	372725
PubChem CID:	131303346
Reduced:	O2S2C11H12 (1)
Stoich.:	A2B2C11D12 (1)
Weight, g/mol:	195.105942
ΔH_f, kcal/mol:	-51.36
Dipole, Da:	4.73
IP(EA), eV:	-8.16(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(3-fluorocyclobutyl)methoxy]aniline

Drug info:

PubChemData

Smile

CCOC1=CC2=C(S1)C(=C(C=C2)SC)O

DOS

IR

Vibrations