Geometry & MOs

Info

ID:	52806
PubChem CID:	14708987
Reduced:	SN2O3H16C20 (1)
Stoich.:	AB2C3D16E20 (1)
Weight, g/mol:	378.103814
ΔH_f, kcal/mol:	-37.66
Dipole, Da:	7.57
IP(EA), eV:	-8.09(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 1-amino-2-benzoyl-8-methylthieno[3,2-a]indolizine-4-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C2C(=C3N1C=CC=C3)C(=C(S2)C(=O)C4=CC=CC=C4)N

DOS

IR

Vibrations