Geometry & MOs

Info

ID:	262977
PubChem CID:	103332013
Reduced:	ClOSN3H10C13 (1)
Stoich.:	ABCD3E10F13 (1)
Weight, g/mol:	299.109233
ΔH_f, kcal/mol:	33.15
Dipole, Da:	3.85
IP(EA), eV:	-8.71(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-tert-butylphenoxy)thieno[2,3-d]pyrimidin-2-amine

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)Cl)OC2=C3C=CSC3=NC(=N2)N

DOS

IR

Vibrations