Geometry & MOs

Info

ID:	423180
PubChem CID:	135119056
Reduced:	FSN3O4C17H26 (1)
Stoich.:	ABC3D4E17F26 (1)
Weight, g/mol:	280.124549
ΔH_f, kcal/mol:	-194.76
Dipole, Da:	6.25
IP(EA), eV:	-9.23(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1S,5S)-7-methyl-3-oxa-7,9-diazabicyclo[3.3.2]decan-9-yl]-(5-methylthiophen-2-yl)methanone

Drug info:

PubChemData

Smile

CN(C)S(=O)(=O)C[C@@H]1COC[C@H]1NC(=O)CN(C)CC2=CC=C(C=C2)F

DOS

IR

Vibrations