Geometry & MOs

Info

ID:	138701
PubChem CID:	52412922
Reduced:	N2O2F3C19H21 (1)
Stoich.:	A2B2C3D19E21 (1)
Weight, g/mol:	343.200825
ΔH_f, kcal/mol:	-186.86
Dipole, Da:	2.97
IP(EA), eV:	-8.18(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-2-(cyclohexylcarbamoylamino)acetamide

Drug info:

PubChemData

Smile

C1CN(CCN1CC2=CC(=CC=C2)OCC(F)(F)F)C3=CC=CC=C3O

DOS

IR

Vibrations