Geometry & MOs

Info

ID:	426636
PubChem CID:	135153064
Reduced:	F3O3N4C24H31 (1)
Stoich.:	A3B3C4D24E31 (1)
Weight, g/mol:	310.125218
ΔH_f, kcal/mol:	-246.55
Dipole, Da:	8.36
IP(EA), eV:	-9.1(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-imidazo[1,2-a]pyrimidin-6-yl-4,4,5,5-tetramethylthieno[2,3-c]pyridine

Drug info:

PubChemData

Smile

CC(C)CN(C1CCOCC1)C2=C(C=C(C=C2)C(C)CC(=O)O)NC3=NN=C(C=C3)C(F)(F)F

DOS

IR

Vibrations