Geometry & MOs

Info

ID:	369255
PubChem CID:	127331627
Reduced:	NOSF3C9H14 (1)
Stoich.:	ABCD3E9F14 (1)
Weight, g/mol:	241.150036
ΔH_f, kcal/mol:	-225.76
Dipole, Da:	4.61
IP(EA), eV:	-8.98(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,3-dimethylthiomorpholin-4-yl)-(1-methylcyclopentyl)methanone

Drug info:

PubChemData

Smile

CC1C(SCCN1C(=O)CC(F)(F)F)C

DOS

IR

Vibrations