Geometry & MOs

Info

ID:	145775
PubChem CID:	53591156
Reduced:	N2O3C19H26 (1)
Stoich.:	A2B3C19D26 (1)
Weight, g/mol:	349.19026
ΔH_f, kcal/mol:	-104.41
Dipole, Da:	4.43
IP(EA), eV:	-8.55(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-methyl-1H-indol-3-yl)-1-[4-(pyridazin-3-ylamino)piperidin-1-yl]ethanone

Drug info:

PubChemData

Smile

CCN1CCCC1C2CCCN2C(=O)C3=CC4=C(C=C3)OCCO4

DOS

IR

Vibrations