Geometry & MOs

Info

ID:	209920
PubChem CID:	80739236
Reduced:	ClNOS2C12H12 (1)
Stoich.:	ABCD2E12F12 (1)
Weight, g/mol:	301.014368
ΔH_f, kcal/mol:	-10.18
Dipole, Da:	5.27
IP(EA), eV:	-8.75(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-fluoro-2-thieno[3,2-b]thiophen-5-ylquinazolin-4-amine

Drug info:

PubChemData

Smile

C1CC(N(C1)C(=O)C2=CC3=C(S2)C=CS3)CCl

DOS

IR

Vibrations