Geometry & MOs

Info

ID:	25805
PubChem CID:	630973
Reduced:	O3C22H28 (1)
Stoich.:	A3B22C28 (1)
Weight, g/mol:	340.088164
ΔH_f, kcal/mol:	-141.26
Dipole, Da:	4.19
IP(EA), eV:	-8.41(0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[(2-thiophen-2-ylquinoline-4-carbonyl)amino]acetate

Drug info:

PubChemData

Smile

CC12CCC3C(C1CCC24CCC(=O)O4)CCC5=C3C=CC(=C5)OC

DOS

IR

Vibrations