Geometry & MOs

Info

ID:	206609
PubChem CID:	80273314
Reduced:	FOSN2C13H17 (1)
Stoich.:	ABCD2E13F17 (1)
Weight, g/mol:	268.104563
ΔH_f, kcal/mol:	-74.41
Dipole, Da:	3.29
IP(EA), eV:	-8.85(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-amino-2-methyl-3-sulfanylidenepropyl)-2-fluoro-N,4-dimethylbenzamide

Drug info:

PubChemData

Smile

CCN(CCC(=S)N)C(=O)C1=C(C=C(C=C1)C)F

DOS

IR

Vibrations