Geometry & MOs

Info

ID:	280886
PubChem CID:	103851769
Reduced:	ClFNSC14H19 (1)
Stoich.:	ABCDE14F19 (1)
Weight, g/mol:	271.120627
ΔH_f, kcal/mol:	-51.71
Dipole, Da:	4.16
IP(EA), eV:	-8.61(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3,5-difluorophenyl)methyl]-3-methylsulfanylcyclohexan-1-amine

Drug info:

PubChemData

Smile

CSC1CCCC(C1)NCC2=CC(=C(C=C2)F)Cl

DOS

IR

Vibrations