Geometry & MOs

Info

ID:	262976
PubChem CID:	103331940
Reduced:	OSN4H12C13 (1)
Stoich.:	ABC4D12E13 (1)
Weight, g/mol:	291.023311
ΔH_f, kcal/mol:	59.61
Dipole, Da:	3.45
IP(EA), eV:	-8.72(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-chloro-5-methylphenoxy)thieno[2,3-d]pyrimidin-2-amine

Drug info:

PubChemData

Smile

CCNC1=NC(=C2C=CSC2=N1)OC3=CN=CC=C3

DOS

IR

Vibrations