Geometry & MOs

Info

ID:	313813
PubChem CID:	126617984
Reduced:	ClF4N4O5C28H29 (1)
Stoich.:	AB4C4D5E28F29 (1)
Weight, g/mol:	480.136446
ΔH_f, kcal/mol:	-384.97
Dipole, Da:	2.16
IP(EA), eV:	-10.0(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(2-amino-3-chloropyridin-4-yl)oxy-3-fluorophenyl]-6-ethyl-1,2-dimethyl-4-oxoquinoline-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CC(NC(=O)C1)C(=O)N(C2=CC(=CC(=C2)F)F)C(C3=CC=CC=C3Cl)C(=O)NC4CC(C4)(F)F

DOS

IR

Vibrations