Geometry & MOs

Info

ID:	268980
PubChem CID:	103603832
Reduced:	N3O3C12H25 (1)
Stoich.:	A3B3C12D25 (1)
Weight, g/mol:	295.135448
ΔH_f, kcal/mol:	-162.29
Dipole, Da:	4.26
IP(EA), eV:	-9.58(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[3-(2-methylpropoxy)propylamino]methyl]-1H-thieno[3,2-d]pyrimidin-4-one

Drug info:

PubChemData

Smile

CC(C)COCCCNC(C)C(=O)NC(=O)NC

DOS

IR

Vibrations