Geometry & MOs

Info

ID:	52794
PubChem CID:	14708968
Reduced:	SN2O6C23H24 (1)
Stoich.:	AB2C6D23E24 (1)
Weight, g/mol:	315.092915
ΔH_f, kcal/mol:	-142.34
Dipole, Da:	5.41
IP(EA), eV:	-8.5(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-acetyl-1,6-dimethylthieno[2,3-b]indolizine-4-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C2C(=CC(=CN2C(=C1SCC3=CC=CC=C3[N+](=O)[O-])C(=O)OCC)C)C

DOS

IR

Vibrations