Geometry & MOs

Info

ID:	338561
PubChem CID:	127259572
Reduced:	N2C13H14 (1)
Stoich.:	A2B13C14 (1)
Weight, g/mol:	283.97313
ΔH_f, kcal/mol:	58.28
Dipole, Da:	7.02
IP(EA), eV:	-8.74(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2E)-2-[1-[(2-bromo-1,3-thiazol-5-yl)methyl]imidazolidin-2-ylidene]acetonitrile

Drug info:

PubChemData

Smile

C1C/C(=C\C#N)/N(C1)CC2=CC=CC=C2

DOS

IR

Vibrations