Geometry & MOs

Info

ID:	232599
PubChem CID:	87576493
Reduced:	OSeC11H12 (1)
Stoich.:	ABC11D12 (1)
Weight, g/mol:	198.067224
ΔH_f, kcal/mol:	-15.09
Dipole, Da:	2.64
IP(EA), eV:	-8.32(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-5,5-dimethyl-6,7-dihydropyrrolo[2,3-d]pyrimidin-2-amine

Drug info:

PubChemData

Smile

CCCOC1=CC2=C(C=C1)C=C[Se]2

DOS

IR

Vibrations