Geometry & MOs

Info

ID:

214662

PubChem CID:

85083368

Reduced:

OC6H7 (6)

Stoich.:

AB6C7 (6)

Weight, g/mol:

570.224513

ΔHf, kcal/mol:

-173.57

Dipole, Da:

3.35

IP(EA), eV:

 -9.22(0.24)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[6-[(4-chlorophenyl)methoxymethyl]-5-hydroxy-4-methoxy-2-(naphthalen-2-ylmethoxy)oxan-3-yl]-3-(diaminomethylideneamino)propanamide

Drug info:

PubChemData

Smile

C=CCOC1C2C(C(C(C1OCC3=CC=CC=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5)OC6(O2)CCCCC6

DOS

IR

Vibrations