Geometry & MOs

Info

ID:	71832
PubChem CID:	48415517
Reduced:	ON5C21H21 (1)
Stoich.:	AB5C21D21 (1)
Weight, g/mol:	369.18009
ΔH_f, kcal/mol:	64.76
Dipole, Da:	1.22
IP(EA), eV:	-8.94(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-1-(2-methoxyethyl)-N-methyl-6-oxopyridazine-3-carboxamide

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)C3=CC(=NN3)C4=CC=CC=C4

DOS

IR

Vibrations