Geometry & MOs

Info

ID:	190302
PubChem CID:	77982484
Reduced:	NO3C18H19 (1)
Stoich.:	AB3C18D19 (1)
Weight, g/mol:	458.268176
ΔH_f, kcal/mol:	-93.91
Dipole, Da:	4.16
IP(EA), eV:	-8.75(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[[4-(2,5-dimethylbenzimidazol-1-yl)-3-hydroxypiperidin-1-yl]methyl]-2,3-dihydro-1H-inden-5-yl]cyclopropanecarboxamide

Drug info:

PubChemData

Smile

CCN1C(=O)CCC(=CC2=CC3=C(C=C2)OC(=C3C)C)C1=O

DOS

IR

Vibrations