Geometry & MOs

Info

ID:	370446
PubChem CID:	127338889
Reduced:	NOSC12H21 (1)
Stoich.:	ABCD12E21 (1)
Weight, g/mol:	239.098
ΔH_f, kcal/mol:	-74.5
Dipole, Da:	3.25
IP(EA), eV:	-8.7(0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,5-dimethylfuran-3-yl)-(3-methylthiomorpholin-4-yl)methanone

Drug info:

PubChemData

Smile

CC1CSCCN1C(=O)CC2CCCC2

DOS

IR

Vibrations