Geometry & MOs

Info

ID:	58188
PubChem CID:	24434749
Reduced:	ON4C17H18 (1)
Stoich.:	AB4C17D18 (1)
Weight, g/mol:	456.179755
ΔH_f, kcal/mol:	55.61
Dipole, Da:	8.01
IP(EA), eV:	-8.74(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[[4-[(E)-[[2-(2-methylbenzimidazol-1-yl)acetyl]hydrazinylidene]methyl]phenoxy]methyl]benzoate

Drug info:

PubChemData

Smile

CC1=NC2=CC=CC=C2N1CC(=O)N/N=C/3\CC4C3CC=C4

DOS

IR

Vibrations