Geometry & MOs

Info

ID:	205024
PubChem CID:	80045941
Reduced:	FNSO2C16H24 (1)
Stoich.:	ABCD2E16F24 (1)
Weight, g/mol:	313.151178
ΔH_f, kcal/mol:	-127.39
Dipole, Da:	5.41
IP(EA), eV:	-8.66(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-fluorophenyl)sulfonyl-N-methyl-4-propylcyclohexan-1-amine

Drug info:

PubChemData

Smile

CCNC1CCCCCCC1S(=O)(=O)C2=CC=CC(=C2)F

DOS

IR

Vibrations