Geometry & MOs

Info

ID:

438949

PubChem CID:

135228710

Reduced:

O2N4C33H48 (1)

Stoich.:

A2B4C33D48 (1)

Weight, g/mol:

488.41305

ΔHf, kcal/mol:

-61.71

Dipole, Da:

7.94

IP(EA), eV:

 -7.73(-0.46)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(Z)-2-[5-(2,3-dimethylbutyl)-2-ethyl-4-[(E,5Z)-5-ethylidene-4,6-dimethylidenenon-2-en-2-yl]phenyl]-3-(2-methylpropylimino)prop-1-en-1-amine

Drug info:

PubChemData

Smile

CCCC(CCNC)N=C/C(=C\N)/C1=C(C=C2C(=C1)CC(N3C2=CC(=C)C(=C3)C(=O)OCC)C(C)(C)C)CC

DOS

IR

Vibrations