Geometry & MOs

Info

ID:	120911
PubChem CID:	50750177
Reduced:	OSN5C17H19 (1)
Stoich.:	ABC5D17E19 (1)
Weight, g/mol:	365.185175
ΔH_f, kcal/mol:	52.11
Dipole, Da:	9.09
IP(EA), eV:	-8.89(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3-methoxypropyl)-3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-8-yl]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=NC2=NC(=NN12)C3=CC=CS3)C)CC(=O)N4CCCC4

DOS

IR

Vibrations