Geometry & MOs

Info

ID:	21946
PubChem CID:	594102
Reduced:	ClFOSN3C13H17 (1)
Stoich.:	ABCDE3F13G17 (1)
Weight, g/mol:	317.076489
ΔH_f, kcal/mol:	-19.83
Dipole, Da:	1.08
IP(EA), eV:	-8.44(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[(2-chloro-6-fluorophenyl)methoxy]-2-thiomorpholin-4-ylethanimidamide

Drug info:

PubChemData

Smile

C1CSCCN1CC(=NOCC2=C(C=CC=C2Cl)F)N

DOS

IR

Vibrations