Geometry & MOs

Info

ID:	430713
PubChem CID:	135170780
Reduced:	ON2C12H15 (2)
Stoich.:	AB2C12D15 (2)
Weight, g/mol:	371.232125
ΔH_f, kcal/mol:	16.52
Dipole, Da:	2.61
IP(EA), eV:	-8.79(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-N-[(1S,3R)-3-[[1-(hydroxyamino)-2-methylpropylidene]amino]cyclohexyl]-1H-benzimidazole-2-carboxamide

Drug info:

PubChemData

Smile

CCN(C1CCCC(C1)NCC2=CC(=NO2)C3CC3)C(=O)C4=CC5=CC=CC=C5N4

DOS

IR

Vibrations