Geometry & MOs

Info

ID:	187890
PubChem CID:	77638901
Reduced:	FO4N5C24H28 (1)
Stoich.:	AB4C5D24E28 (1)
Weight, g/mol:	396.252526
ΔH_f, kcal/mol:	-156.02
Dipole, Da:	5.39
IP(EA), eV:	-9.33(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2,3-dihydroindol-1-yl)ethyl]-8-oxo-2-pyrazol-1-yldecanamide

Drug info:

PubChemData

Smile

C1CC2C(=NC1)C(=NNC2=O)CC3=CC(=C(C=C3)F)C(=O)N4CCN(CC4)C(=O)C5CCCO5

DOS

IR

Vibrations