Geometry & MOs

Info

ID:

189156

PubChem CID:

77823794

Reduced:

N3O4C32H35 (1)

Stoich.:

A3B4C32D35 (1)

Weight, g/mol:

653.382872

ΔHf, kcal/mol:

-73.44

Dipole, Da:

8.63

IP(EA), eV:

 -8.69(-0.29)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

tert-butyl 3-[cyclopropyl-[[1-(3-methoxypropyl)-2,3-dihydroindol-3-yl]methyl]carbamoyl]-4-(3-methoxy-5-phenylphenyl)piperidine-1-carboxylate

Drug info:

PubChemData

Smile

COCCCN1C2=C(C=CC(=C2)N(C3CC3)C(=O)C4CNCCC4C5=CC=CC(=C5)C6=CC=CC=C6)OC1=O

DOS

IR

Vibrations