Geometry & MOs

Info

ID:	271681
PubChem CID:	103688058
Reduced:	ClFSN2O2H10C14 (1)
Stoich.:	ABCD2E2F10G14 (1)
Weight, g/mol:	273.111341
ΔH_f, kcal/mol:	-61.95
Dipole, Da:	2.15
IP(EA), eV:	-9.3(-1.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-methyl-3-oxopiperazine-1-carbonyl)-1,3-dihydroindol-2-one

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C#N)S(=O)(=O)NC2=C(C=CC(=C2)F)Cl

DOS

IR

Vibrations