Geometry & MOs

Info

ID:	174759
PubChem CID:	75811898
Reduced:	ClSN2O4C23H23 (1)
Stoich.:	ABC2D4E23F23 (1)
Weight, g/mol:	243.08262
ΔH_f, kcal/mol:	-84.29
Dipole, Da:	4.27
IP(EA), eV:	-9.54(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(2-chloro-4-fluorophenyl)methyl]-3-methylmorpholine

Drug info:

PubChemData

Smile

CCC(C1=CC(=CC=C1)Cl)NC(=O)C=CC2=CC=C(C=C2)S(=O)(=O)NCC3=CC=CO3

DOS

IR

Vibrations