Geometry & MOs

Info

ID:	360409
PubChem CID:	127301054
Reduced:	ClON6C20H23 (1)
Stoich.:	ABC6D20E23 (1)
Weight, g/mol:	368.221226
ΔH_f, kcal/mol:	66.34
Dipole, Da:	5.01
IP(EA), eV:	-9.11(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,6,6-trimethyl-2-[3-(4-methylpyrazol-1-yl)piperidine-1-carbonyl]-5,7-dihydro-1H-indol-4-one

Drug info:

PubChemData

Smile

CCC1=NC(=NN1C2=CC=CC=C2Cl)C(=O)N3CCCC(C3)N4C=C(C=N4)C

DOS

IR

Vibrations