Geometry & MOs

Info

ID:	148338
PubChem CID:	53788000
Reduced:	N2O3C11H20 (1)
Stoich.:	A2B3C11D20 (1)
Weight, g/mol:	421.166251
ΔH_f, kcal/mol:	-119.79
Dipole, Da:	1.26
IP(EA), eV:	-8.61(0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[6-fluoro-4-[[(2R)-5-oxopyrrolidin-2-yl]methoxy]-1H-benzimidazol-2-yl]methyl]-3H-benzimidazole-5-carboximidamide

Drug info:

PubChemData

Smile

CC(=NN1CCC[C@@H]1COC)CC(=O)OC

DOS

IR

Vibrations