Geometry & MOs

Info

ID:	262394
PubChem CID:	103290307
Reduced:	NOF4C15H19 (1)
Stoich.:	ABC4D15E19 (1)
Weight, g/mol:	301.126713
ΔH_f, kcal/mol:	-216.86
Dipole, Da:	3.76
IP(EA), eV:	-9.28(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-chlorophenyl)methylsulfinyl]-N-propylpentan-3-amine

Drug info:

PubChemData

Smile

CC1CCCCC1NCCOC2=C(C(=CC(=C2F)F)F)F

DOS

IR

Vibrations