Geometry & MOs

Info

ID:

219268

PubChem CID:

85098326

Reduced:

N7O8C33H45 (1)

Stoich.:

A7B8C33D45 (1)

Weight, g/mol:

667.446141

ΔHf, kcal/mol:

-283.87

Dipole, Da:

5.96

IP(EA), eV:

 -9.62(-0.95)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[1-[3-[4-[cyclopropylmethyl-[1-[(4-methoxypyridin-3-yl)methyl]piperidin-4-yl]amino]butoxy]propyl]pyrrolidin-3-yl]-2,2-diphenylacetamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC(CCCCNC(=O)OCC1=CC=CC=C1)C(=O)NC(CCCCNC(=O)OCC2=CC=CC=C2)C(=O)N=[N+]=[N-]

DOS

IR

Vibrations