Geometry & MOs

Info

ID:	357730
PubChem CID:	127294404
Reduced:	O3S3N5C9H15 (1)
Stoich.:	A3B3C5D9E15 (1)
Weight, g/mol:	308.153621
ΔH_f, kcal/mol:	-72.51
Dipole, Da:	6.02
IP(EA), eV:	-8.68(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(4-fluorophenyl)oxan-4-yl]morpholine-4-carboxamide

Drug info:

PubChemData

Smile

C1CSCCN1S(=O)(=O)CCNC(=O)NC2=NN=CS2

DOS

IR

Vibrations