Geometry & MOs

Info

ID:	204932
PubChem CID:	80034023
Reduced:	FNSO3H14C15 (1)
Stoich.:	ABCD3E14F15 (1)
Weight, g/mol:	305.176662
ΔH_f, kcal/mol:	-105.51
Dipole, Da:	3.98
IP(EA), eV:	-8.73(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-fluoro-5-(trifluoromethyl)phenyl]-N-propylhexan-1-amine

Drug info:

PubChemData

Smile

COC1=CC=CC=C1NC(=O)CS(=O)C2=CC=CC(=C2)F

DOS

IR

Vibrations