Geometry & MOs

Info

ID:	182631
PubChem CID:	76916903
Reduced:	OS2N3C12H17 (1)
Stoich.:	AB2C3D12E17 (1)
Weight, g/mol:	283.081305
ΔH_f, kcal/mol:	14.85
Dipole, Da:	4.24
IP(EA), eV:	-8.75(-1.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(dimethylamino)-2-methylpropyl]-2-sulfanylidene-4aH-thieno[3,2-d]pyrimidin-4-one

Drug info:

PubChemData

Smile

CC(C)(CN1C(=O)C2C=CSC2=NC1=S)N(C)C

DOS

IR

Vibrations