Geometry & MOs

Info

ID:	367513
PubChem CID:	127324850
Reduced:	ON5C21H35 (1)
Stoich.:	AB5C21D35 (1)
Weight, g/mol:	395.19574
ΔH_f, kcal/mol:	-26.93
Dipole, Da:	5.14
IP(EA), eV:	-8.53(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-[methyl-(6-methylpyridazin-3-yl)amino]piperidine-1-carbonyl]-1,6,7,8-tetrahydroquinoline-2,5-dione

Drug info:

PubChemData

Smile

CC1=NN=C(C=C1)N(C)C2CCN(CC2)C(=O)C(C(C)C)N3CCCCC3

DOS

IR

Vibrations