Geometry & MOs

Info

ID:	88889
PubChem CID:	49957409
Reduced:	ClOSN3C16H16 (1)
Stoich.:	ABCD3E16F16 (1)
Weight, g/mol:	241.132746
ΔH_f, kcal/mol:	23.6
Dipole, Da:	2.2
IP(EA), eV:	-8.13(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-azido-1-cyclohexylbenzimidazole

Drug info:

PubChemData

Smile

CN1C2=C(C=C(C=C2)N)N=C1SCCOC3=CC=C(C=C3)Cl

DOS

IR

Vibrations