Geometry & MOs

Info

ID:	354901
PubChem CID:	127287661
Reduced:	SO2N3C12H15 (1)
Stoich.:	AB2C3D12E15 (1)
Weight, g/mol:	320.094312
ΔH_f, kcal/mol:	-14.08
Dipole, Da:	4.11
IP(EA), eV:	-9.35(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[(1-cyclopropyl-4-oxopyrimidin-2-yl)sulfanylmethyl]-1,3-dimethylpyrimidine-2,4-dione

Drug info:

PubChemData

Smile

C1CN(C1)C(=O)CSC2=NC(=O)C=CN2C3CC3

DOS

IR

Vibrations