Geometry & MOs

Info

ID:	369240
PubChem CID:	127331591
Reduced:	SO2N3C14H21 (1)
Stoich.:	AB2C3D14E21 (1)
Weight, g/mol:	373.146013
ΔH_f, kcal/mol:	-74.31
Dipole, Da:	5.58
IP(EA), eV:	-8.47(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-benzyl-3-[2-(2,3-dimethylthiomorpholin-4-yl)-2-oxoethyl]pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CC1C(SCCN1C(=O)C2=C(C(=NN(C2=O)C)C)C)C

DOS

IR

Vibrations