Geometry & MOs

Info

ID:	231285
PubChem CID:	87573362
Reduced:	O5C11H22 (1)
Stoich.:	A5B11C22 (1)
Weight, g/mol:	483.232006
ΔH_f, kcal/mol:	-261.93
Dipole, Da:	2.04
IP(EA), eV:	-10.66(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

(2R)-1-[5,7-difluoro-3-methyl-4-[(5-morpholin-4-ylpyridin-3-yl)amino]quinolin-2-yl]-1-methylpyrrolidin-1-ium-2-carboxamide

Drug info:

PubChemData

Smile

CCCCCCCC(=O)C(C(CO)(O)O)O

DOS

IR

Vibrations