Geometry & MOs

Info

ID:	263008
PubChem CID:	103333480
Reduced:	FSN5H12C13 (1)
Stoich.:	ABC5D12E13 (1)
Weight, g/mol:	305.156184
ΔH_f, kcal/mol:	48.49
Dipole, Da:	3.43
IP(EA), eV:	-8.68(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4,4-dimethylcyclohexyl)oxy-N,6-dimethylthieno[2,3-d]pyrimidin-2-amine

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)NC2=C3C=CSC3=NC(=N2)NN)F

DOS

IR

Vibrations