Geometry & MOs

Info

ID:	262821
PubChem CID:	103320918
Reduced:	ClSN4C15H15 (1)
Stoich.:	ABC4D15E15 (1)
Weight, g/mol:	307.054611
ΔH_f, kcal/mol:	75.44
Dipole, Da:	4.76
IP(EA), eV:	-8.78(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-6-ethyl-N-[2-(furan-2-yl)ethyl]thieno[2,3-d]pyrimidin-4-amine

Drug info:

PubChemData

Smile

CCN(CC1=CC=NC=C1)C2=C3C=C(SC3=NC(=N2)Cl)C

DOS

IR

Vibrations