Geometry & MOs

Info

ID:

219186

PubChem CID:

85091323

Reduced:

NO5C43H69 (1)

Stoich.:

AB5C43D69 (1)

Weight, g/mol:

681.498176

ΔHf, kcal/mol:

-282.01

Dipole, Da:

4.94

IP(EA), eV:

 -8.49(-0.36)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[1-[7-[[1-[[4-(2-methylpropoxy)pyridin-3-yl]methyl]piperidin-4-yl]-propan-2-ylamino]heptyl]pyrrolidin-3-yl]-2,2-diphenylacetamide

Drug info:

PubChemData

Smile

CCCCCCCCCOC1=CC(=CC(=C1O)OCCCCCCCCC)C=CC(=O)NCCC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

DOS

IR

Vibrations