Geometry & MOs

Info

ID:	30032
PubChem CID:	839010
Reduced:	S2N5C12H17 (1)
Stoich.:	A2B5C12D17 (1)
Weight, g/mol:	290.108899
ΔH_f, kcal/mol:	60.3
Dipole, Da:	0.27
IP(EA), eV:	-8.56(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (6S)-3-amino-6-methyl-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxylate

Drug info:

PubChemData

Smile

CCSC1=NC(=C2C3=C(CN(CC3)C)SC2=N1)NN

DOS

IR

Vibrations