Geometry & MOs

Info

ID:	30261
PubChem CID:	841055
Reduced:	FNSO2C15H16 (1)
Stoich.:	ABCD2E15F16 (1)
Weight, g/mol:	271.137242
ΔH_f, kcal/mol:	-85.9
Dipole, Da:	4.18
IP(EA), eV:	-9.57(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R)-1-(2,5-dimethylphenyl)ethyl]-3-fluorobenzamide

Drug info:

PubChemData

Smile

CC[C@H](C1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)F

DOS

IR

Vibrations