Geometry & MOs

Info

ID:	227962
PubChem CID:	87563133
Reduced:	SSnO2H5C6 (1)
Stoich.:	ABC2D5E6 (1)
Weight, g/mol:	211.05124
ΔH_f, kcal/mol:	16.78
Dipole, Da:	2.52
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.926914
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-propan-2-ylfuro[3,2-d]pyrimidin-4-amine

Drug info:

PubChemData

Smile

C1COC2=C(SC=C2O1)[Sn]

DOS

IR

Vibrations