Geometry & MOs

Info

ID:	49947
PubChem CID:	11538280
Reduced:	F3N3O3H12C19 (1)
Stoich.:	A3B3C3D12E19 (1)
Weight, g/mol:	387.061295
ΔH_f, kcal/mol:	-151.99
Dipole, Da:	11.52
IP(EA), eV:	-9.28(-1.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(2-oxo-1,3-dihydroindol-5-yl)amino]-5-(trifluoromethyl)pyrimidin-4-yl]methanesulfonamide

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)C=C(C(=O)O2)N3C=C(N=N3)C4=CC=C(C=C4)C(F)(F)F

DOS

IR

Vibrations