Geometry & MOs

Info

ID:	205141
PubChem CID:	80059977
Reduced:	FNOSC12H18 (1)
Stoich.:	ABCDE12F18 (1)
Weight, g/mol:	253.130049
ΔH_f, kcal/mol:	-82.98
Dipole, Da:	2.65
IP(EA), eV:	-8.95(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-fluorophenyl)sulfanyl-4,4-dimethylcyclohexan-1-amine

Drug info:

PubChemData

Smile

CCNC(CCO)CSC1=CC=CC(=C1)F

DOS

IR

Vibrations