Geometry & MOs

Info

ID:	168416
PubChem CID:	74965414
Reduced:	ON3C9H14 (2)
Stoich.:	AB3C9D14 (2)
Weight, g/mol:	545.325357
ΔH_f, kcal/mol:	-61.6
Dipole, Da:	6.02
IP(EA), eV:	-8.63(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[2-[3-(4,7-dimethoxy-1H-benzimidazol-2-yl)propyl-methylamino]ethyl]-5-phenyl-2-bicyclo[2.2.2]oct-5-enyl] 2-methylpropanoate

Drug info:

PubChemData

Smile

CC1=NC(=NC=C1C2CC(=O)NC(N2)NCC3CCCO3)N4CCCC4

DOS

IR

Vibrations