Geometry & MOs

Info

ID:	52815
PubChem CID:	14709002
Reduced:	NSO4H13C15 (1)
Stoich.:	ABC4D13E15 (1)
Weight, g/mol:	317.072179
ΔH_f, kcal/mol:	-118.96
Dipole, Da:	4.38
IP(EA), eV:	-8.49(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC(=O)C1=C2C=CC=CN2C3=C1SC(=C3O)C(=O)C

DOS

IR

Vibrations