Geometry & MOs

Info

ID:

151122

PubChem CID:

53790820

Reduced:

O2C17H22 (1)

Stoich.:

A2B17C22 (1)

Weight, g/mol:

1090.530324

ΔHf, kcal/mol:

-65.85

Dipole, Da:

1.72

IP(EA), eV:

 -8.85(0.0)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1,3-diphenylpropyl 1-[4-[[4-[[[4-[2-(1,3-diphenylpropoxycarbonyl)piperidin-1-yl]-2,2-dimethyl-3,4-dioxobutoxy]carbonylamino]methyl]phenyl]methylcarbamoyloxy]-3,3-dimethyl-2-oxobutanoyl]piperidine-2-carboxylate

Drug info:

PubChemData

Smile

CC(=CCCC=CC1=CC=CC=C1)CCC(=O)OC

DOS

IR

Vibrations