Geometry & MOs

Info

ID:	293682
PubChem CID:	117396635
Reduced:	FNSO2C12H16 (1)
Stoich.:	ABCD2E12F16 (1)
Weight, g/mol:	257.159121
ΔH_f, kcal/mol:	-116.6
Dipole, Da:	8.96
IP(EA), eV:	-9.68(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-(1,1-difluoroethyl)-2-methoxy-6-methylphenyl]-2-methylpropan-2-amine

Drug info:

PubChemData

Smile

CC1(CCCN1)C2=C(C(=CC=C2)F)S(=O)(=O)C

DOS

IR

Vibrations