Geometry & MOs

Info

ID:	139141
PubChem CID:	52482431
Reduced:	SN2F3O4C15H19 (1)
Stoich.:	AB2C3D4E15F19 (1)
Weight, g/mol:	368.09277
ΔH_f, kcal/mol:	-312.41
Dipole, Da:	7.96
IP(EA), eV:	-9.36(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-chloroquinolin-8-yl)oxy-N-[(4R)-3,4-dihydro-2H-chromen-4-yl]acetamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)OC)S(=O)(=O)N[C@@H]2CCN(C2)CC(F)(F)F

DOS

IR

Vibrations