Geometry & MOs

Info

ID:

379566

PubChem CID:

134445582

Reduced:

N3H45C58 (1)

Stoich.:

A3B45C58 (1)

Weight, g/mol:

376.251464

ΔHf, kcal/mol:

262.21

Dipole, Da:

0.59

IP(EA), eV:

 -8.93(-1.09)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

4-(cyclobutylidenemethyl)-2-methoxy-N-[(E)-4-methyl-4-[2-(methylamino)phenyl]pent-1-enyl]aniline

Drug info:

PubChemData

Smile

CC/C(=C\C=C/CC1=CC(=CC=C1)C2=C(C(=C(C(=C2)C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6)/C7=NC(=NC(=N7)C8=CC=CC=C8)C9=CC=CC=C9

DOS

IR

Vibrations