Geometry & MOs

Info

ID:	257852
PubChem CID:	103148822
Reduced:	OSF2N2C10H16 (1)
Stoich.:	ABC2D2E10F16 (1)
Weight, g/mol:	257.159121
ΔH_f, kcal/mol:	-132.83
Dipole, Da:	3.58
IP(EA), eV:	-9.18(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,2-difluoroethoxy)-1-(2,5-dimethylphenyl)butan-2-amine

Drug info:

PubChemData

Smile

CC1=NC(=CS1)CC(CCOCC(F)F)N

DOS

IR

Vibrations