Geometry & MOs

Info

ID:	249401
PubChem CID:	103089173
Reduced:	ClOSN2C12H17 (1)
Stoich.:	ABCD2E12F17 (1)
Weight, g/mol:	356.016447
ΔH_f, kcal/mol:	-38.46
Dipole, Da:	1.51
IP(EA), eV:	-8.57(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(2,4-dichloro-3-fluorophenyl)sulfonylmorpholin-2-yl]ethanamine

Drug info:

PubChemData

Smile

CSCCCC(C(=O)N)NC1=CC=CC=C1Cl

DOS

IR

Vibrations