Geometry & MOs

Info

ID:	369728
PubChem CID:	127335158
Reduced:	ON4C21H26 (1)
Stoich.:	AB4C21D26 (1)
Weight, g/mol:	363.20591
ΔH_f, kcal/mol:	-0.54
Dipole, Da:	5.99
IP(EA), eV:	-8.45(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,6-dimethyl-N-[1-(6-methylpyridazin-3-yl)piperidin-3-yl]-1H-indole-2-carboxamide

Drug info:

PubChemData

Smile

CC1=NN=C(C=C1)N2CCCC(C2)NC(=O)C3CCCC4=CC=CC=C34

DOS

IR

Vibrations