Geometry & MOs

Info

ID:	257869
PubChem CID:	103148895
Reduced:	ClOF2N3C12H20 (1)
Stoich.:	ABC2D3E12F20 (1)
Weight, g/mol:	293.18025
ΔH_f, kcal/mol:	-146.06
Dipole, Da:	1.51
IP(EA), eV:	-9.11(0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,2-difluoroethoxy)-1-(1,9-dioxaspiro[5.5]undecan-4-yl)propan-1-amine

Drug info:

PubChemData

Smile

CCN1C(=C(C(=N1)C)Cl)CC(CCOCC(F)F)N

DOS

IR

Vibrations