Geometry & MOs

Info

ID:	379563
PubChem CID:	134445372
Reduced:	NF3O5C28H34 (1)
Stoich.:	AB3C5D28E34 (1)
Weight, g/mol:	252.100643
ΔH_f, kcal/mol:	-340.13
Dipole, Da:	4.32
IP(EA), eV:	-9.55(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,6-ditert-butylthieno[2,3-c]thiophene

Drug info:

PubChemData

Smile

CC(C)C1=C2[C@H](OC3(C2C4C(CC5(CC5)[C@H](C4=N1)O)O)CCOCC3)C6=CC(=C(C=C6)C(F)(F)F)OC

DOS

IR

Vibrations