Geometry & MOs

Info

ID:	31269
PubChem CID:	855411
Reduced:	ClN6C17H25 (1)
Stoich.:	AB6C17D25 (1)
Weight, g/mol:	327.140533
ΔH_f, kcal/mol:	75.61
Dipole, Da:	5.5
IP(EA), eV:	-8.51(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-N,N,6-triethylthieno[2,3-b]quinoline-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)N1C(=NN=N1)[C@H](C2=CC=CC=C2Cl)N3CCN(CC3)C

DOS

IR

Vibrations