Geometry & MOs

Info

ID:	52802
PubChem CID:	14708983
Reduced:	SN2O4H20C22 (1)
Stoich.:	AB2C4D20E22 (1)
Weight, g/mol:	302.072513
ΔH_f, kcal/mol:	-36.73
Dipole, Da:	8.48
IP(EA), eV:	-8.44(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-acetyl-1-aminothieno[3,2-a]indolizine-4-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C2C(=CC(=CN2C3=C1SC(=C3C)C4=CC=C(C=C4)[N+](=O)[O-])C)C

DOS

IR

Vibrations