Geometry & MOs

Info

ID:

214753

PubChem CID:

85083588

Reduced:

NO6C37H47 (1)

Stoich.:

AB6C37D47 (1)

Weight, g/mol:

601.339687

ΔHf, kcal/mol:

-186.04

Dipole, Da:

5.08

IP(EA), eV:

 -8.36(-0.42)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

5-amino-4-hydroxy-7-[[4-methoxy-3-(3-methoxypropoxy)phenyl]methyl]-2,8-dimethyl-N-(2-morpholin-4-ylsulfonylethyl)nonanamide

Drug info:

PubChemData

Smile

CC(=C)C1C(C2C3(O2)C(O1)CCC4(C3(CCC5C4(C6=C(C5)C7=C(N6)C=CC8=C7C9(C(CC9C(C)(C)O)C(=C)C8)O)C)O)C)O

DOS

IR

Vibrations