Geometry & MOs

Info

ID:	52822
PubChem CID:	14709016
Reduced:	NSO4H19C22 (1)
Stoich.:	ABC4D19E22 (1)
Weight, g/mol:	427.064507
ΔH_f, kcal/mol:	-83.79
Dipole, Da:	6.35
IP(EA), eV:	-8.38(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(4-chlorobenzoyl)-1-methoxy-6-methylthieno[2,3-b]indolizine-4-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C2C=C(C=CN2C3=C1SC(=C3OC)C(=O)C4=CC=CC=C4)C

DOS

IR

Vibrations