Geometry & MOs

Info

ID:	31386
PubChem CID:	855647
Reduced:	ON6C18H26 (1)
Stoich.:	AB6C18D26 (1)
Weight, g/mol:	286.077599
ΔH_f, kcal/mol:	50.24
Dipole, Da:	6.15
IP(EA), eV:	-8.82(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-amino-7,8-dimethylthieno[2,3-b]quinoline-2-carboxylate

Drug info:

PubChemData

Smile

C1C[C@H](OC1)CN2C(=NN=N2)CN3CCN(CC3)CC4=CC=CC=C4

DOS

IR

Vibrations