Geometry & MOs

Info

ID:	189182
PubChem CID:	77825734
Reduced:	SN3O5C21H29 (1)
Stoich.:	AB3C5D21E29 (1)
Weight, g/mol:	435.156099
ΔH_f, kcal/mol:	-196.94
Dipole, Da:	5.44
IP(EA), eV:	-8.76(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 2-carbamoyl-4-(8-chloro-2-ethoxyquinolin-4-yl)oxypyrrolidine-1-carboxylate

Drug info:

PubChemData

Smile

CN(CCC1=CC=CC=C1)C(=O)C(C(C(=O)NCCCNC(=O)C2CC=CS2)O)O

DOS

IR

Vibrations