Geometry & MOs

Info

ID:	404397
PubChem CID:	135066160
Reduced:	O3N4C14H16 (1)
Stoich.:	A3B4C14D16 (1)
Weight, g/mol:	330.12628
ΔH_f, kcal/mol:	-64.5
Dipole, Da:	8.41
IP(EA), eV:	-8.6(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[2,6-bis(dimethylamino)-9-methylpurin-8-yl]thiophene-2-carbaldehyde

Drug info:

PubChemData

Smile

CC1=C(OC(=C1)C2=NC3=C(N2C)N(C(=O)N(C3=O)C)C)C

DOS

IR

Vibrations