Geometry & MOs

Info

ID:	32308
PubChem CID:	6436449
Reduced:	ClON3C17H20 (1)
Stoich.:	ABC3D17E20 (1)
Weight, g/mol:	307.108754
ΔH_f, kcal/mol:	12.08
Dipole, Da:	6.56
IP(EA), eV:	-9.34(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(Z)-[1-methyl-3-[[(Z)-3-phenylprop-2-enoxy]methyl]imidazol-2-ylidene]methyl]-oxoazanium;chloride

Drug info:

PubChemData

Smile

CC1(CC/C(=C/C2=CC=C(C=C2)Cl)/C1(CN3C=NC=N3)O)C

DOS

IR

Vibrations