Geometry & MOs

Info

ID:	172283
PubChem CID:	75488798
Reduced:	ON4C15H18 (1)
Stoich.:	AB4C15D18 (1)
Weight, g/mol:	418.211724
ΔH_f, kcal/mol:	11.22
Dipole, Da:	4.59
IP(EA), eV:	-9.32(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[1-(2-methylpropyl)benzimidazol-2-yl]propyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide

Drug info:

PubChemData

Smile

C1CCC2=C(CC1)NN=C2C(=O)NCC3=CC=CC=N3

DOS

IR

Vibrations