Geometry & MOs

Info

ID:	71823
PubChem CID:	48415507
Reduced:	O2N5C22H23 (1)
Stoich.:	A2B5C22D23 (1)
Weight, g/mol:	327.169525
ΔH_f, kcal/mol:	17.66
Dipole, Da:	4.48
IP(EA), eV:	-8.82(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-N,1-dimethyl-6-oxo-4,5-dihydropyridazine-3-carboxamide

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)CCC3=NN=C(O3)C4=CC=CC=C4

DOS

IR

Vibrations