Geometry & MOs

Info

ID:

180772

PubChem CID:

76683367

Reduced:

NO6C31H53 (1)

Stoich.:

AB6C31D53 (1)

Weight, g/mol:

660.471352

ΔHf, kcal/mol:

-292.11

Dipole, Da:

4.0

IP(EA), eV:

 -8.17(0.29)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

tert-butyl N-[10-(1-azabicyclo[2.2.2]octan-3-yl)-6-hydroxy-3-[[4-methoxy-3-(3-methoxypropoxy)phenyl]methyl]-2-methyl-9-oxo-8-propan-2-yldecan-5-yl]carbamate

Drug info:

PubChemData

Smile

CC(C)C(CC1=CC(=C(C=C1)OC)OCCCOC)CC(C(CC(C(C)C)C(=O)CCC2CCOC2)O)N

DOS

IR

Vibrations