Geometry & MOs

Info

ID:	152420
PubChem CID:	56311346
Reduced:	SO2N3C23H29 (1)
Stoich.:	AB2C3D23E29 (1)
Weight, g/mol:	374.210661
ΔH_f, kcal/mol:	-31.22
Dipole, Da:	6.71
IP(EA), eV:	-8.21(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[4-(5-methoxy-1H-indol-3-yl)piperidin-1-yl]methyl]-1-methylbenzimidazole

Drug info:

PubChemData

Smile

C1CCC(CC1)CN(CC(=O)NC2=CC=C(C=C2)NC(=O)C3=CC=CS3)C4CC4

DOS

IR

Vibrations