Geometry & MOs

Info

ID:	186143
PubChem CID:	77396023
Reduced:	N2O2F3C15H19 (1)
Stoich.:	A2B2C3D15E19 (1)
Weight, g/mol:	562.269239
ΔH_f, kcal/mol:	-235.87
Dipole, Da:	2.78
IP(EA), eV:	-9.25(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-cyano-7-ethoxy-4-[3-methyl-4-(pyridin-2-ylmethoxy)anilino]quinolin-6-yl]-3-(1-methylpyrrolidin-2-yl)prop-2-enamide

Drug info:

PubChemData

Smile

CC(C(F)(F)F)OC(=O)NC1CCN(C1)CC2=CC=CC=C2

DOS

IR

Vibrations