Geometry & MOs

Info

ID:	145414
PubChem CID:	53520834
Reduced:	ClOSN2C15H23 (1)
Stoich.:	ABCD2E15F23 (1)
Weight, g/mol:	376.125692
ΔH_f, kcal/mol:	-50.49
Dipole, Da:	4.73
IP(EA), eV:	-8.79(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[(2-fluorophenyl)methyl]-N-methyl-N-[(2-methylfuran-3-yl)methyl]-5-oxothiomorpholine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)N1CCC(CC1)NC(=O)CCC2=CC=C(S2)Cl

DOS

IR

Vibrations