Geometry & MOs

Info

ID:	350457
PubChem CID:	127277819
Reduced:	OSN2C9H11 (2)
Stoich.:	ABC2D9E11 (2)
Weight, g/mol:	286.135114
ΔH_f, kcal/mol:	-34.35
Dipole, Da:	6.07
IP(EA), eV:	-9.01(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(2,2-dimethylmorpholine-4-carbonyl)-1,3-thiazolidin-3-yl]propan-1-one

Drug info:

PubChemData

Smile

CCC(=O)N1CSCC1C(=O)N2CCN(CC2)C3=NC4=CC=CC=C4S3

DOS

IR

Vibrations