Geometry & MOs

Info

ID:	324481
PubChem CID:	126677742
Reduced:	ON3C28H33 (1)
Stoich.:	AB3C28D33 (1)
Weight, g/mol:	324.16602
ΔH_f, kcal/mol:	21.09
Dipole, Da:	4.57
IP(EA), eV:	-8.41(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[(Z)-2-(2,4-dimethylphenyl)-2-(methylideneamino)ethenyl]sulfanylmethyl]-2-ethylaniline

Drug info:

PubChemData

Smile

CCCCOC1=CC=CC(=C1)CC2=CC(=NC(=C2)N3C(=CC=C3C)C)N4C(=CC=C4C)C

DOS

IR

Vibrations