Geometry & MOs

Info

ID:	329965
PubChem CID:	127246952
Reduced:	ON6C17H24 (1)
Stoich.:	AB6C17D24 (1)
Weight, g/mol:	322.154209
ΔH_f, kcal/mol:	8.85
Dipole, Da:	5.74
IP(EA), eV:	-8.89(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3H-benzimidazol-5-yl-[2-[6-(methylamino)pyrazin-2-yl]pyrrolidin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1=C(C(=NN1)C)CCC(=O)N2CCCC2C3=CN=CC(=N3)NC

DOS

IR

Vibrations