Geometry & MOs

Info

ID:	372776
PubChem CID:	131304516
Reduced:	NOSH3C4 (2)
Stoich.:	ABCD3E4 (2)
Weight, g/mol:	205.046983
ΔH_f, kcal/mol:	-11.04
Dipole, Da:	6.04
IP(EA), eV:	-9.27(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-(4-chloro-2-fluorophenyl)-3-fluoropropan-1-amine

Drug info:

PubChemData

Smile

CC1=NC(=CS1)C2=NSC(=C2)C(=O)O

DOS

IR

Vibrations