Geometry & MOs

Info

ID:	308545
PubChem CID:	126496196
Reduced:	FO2N4C17H23 (1)
Stoich.:	AB2C4D17E23 (1)
Weight, g/mol:	208.101191
ΔH_f, kcal/mol:	-71.16
Dipole, Da:	4.69
IP(EA), eV:	-8.18(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-fluoro-4-(2-oxa-6-azaspiro[3.3]heptan-6-yl)aniline

Drug info:

PubChemData

Smile

CNCC1CN(C(=O)O1)C2=CC(=C(C=C2)N3CC4(C3)CN(C4)C)F

DOS

IR

Vibrations