Geometry & MOs

Info

ID:	250241
PubChem CID:	103095107
Reduced:	ClN3H8C14 (1)
Stoich.:	AB3C8D14 (1)
Weight, g/mol:	234.092376
ΔH_f, kcal/mol:	107.07
Dipole, Da:	3.59
IP(EA), eV:	-9.16(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-7-ethyl-6,7,8,9-tetrahydropyrido[1,2-a]benzimidazole

Drug info:

PubChemData

Smile

C1=CN2C(=CN=C2C(=C1)Cl)C3=CC=C(C=C3)C#N

DOS

IR

Vibrations