Geometry & MOs

Info

ID:	126938
PubChem CID:	50984670
Reduced:	ON3C17H25 (1)
Stoich.:	AB3C17D25 (1)
Weight, g/mol:	364.189926
ΔH_f, kcal/mol:	-27.48
Dipole, Da:	2.26
IP(EA), eV:	-8.9(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,1,6-trimethyl-4-oxo-N-(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)quinoline-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)C(CN1CCCC1)N2CC3=C(C2=O)C=CC=N3

DOS

IR

Vibrations