Geometry & MOs

Info

ID:	445842
PubChem CID:	135269755
Reduced:	N2O3C10H14 (1)
Stoich.:	A2B3C10D14 (1)
Weight, g/mol:	433.218784
ΔH_f, kcal/mol:	-73.64
Dipole, Da:	1.19
IP(EA), eV:	-8.99(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z,3E)-1-(4-ethylphenyl)-3-methoxy-3-[6-methyl-3-(4-propan-2-ylsulfanylphenyl)-2H-pyrazin-5-ylidene]prop-1-en-1-amine

Drug info:

PubChemData

Smile

COCOC1=C(C=CN=C1C(=C)N)OC

DOS

IR

Vibrations