Geometry & MOs

Info

ID:	426832
PubChem CID:	135154094
Reduced:	ClSO2N4C19H21 (1)
Stoich.:	ABC2D4E19F21 (1)
Weight, g/mol:	274.142976
ΔH_f, kcal/mol:	-23.94
Dipole, Da:	5.78
IP(EA), eV:	-8.81(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-oxo-3H-benzimidazol-1-yl)cyclohexane-1-carbohydrazide

Drug info:

PubChemData

Smile

CC1=C(N=C(N=C1Cl)CO)N2CCC(CC2)OC3=CC4=C(C=C3)SC(=N4)C

DOS

IR

Vibrations