Geometry & MOs

Info

ID:	431145
PubChem CID:	135171215
Reduced:	ON4C25H32 (1)
Stoich.:	AB4C25D32 (1)
Weight, g/mol:	415.237211
ΔH_f, kcal/mol:	3.23
Dipole, Da:	3.03
IP(EA), eV:	-9.05(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-N-[3-(indolizin-6-ylmethylamino)cyclohexyl]-1H-benzimidazole-2-carboxamide

Drug info:

PubChemData

Smile

CCN([C@H]1CCCC(C1)NC(C)(C)C2=CC=CC=C2)C(=O)C3=CC4=C(N3)C=CC=N4

DOS

IR

Vibrations