Geometry & MOs

Info

ID:	229162
PubChem CID:	87567083
Reduced:	O5C12H20 (1)
Stoich.:	A5B12C20 (1)
Weight, g/mol:	511.210721
ΔH_f, kcal/mol:	-256.08
Dipole, Da:	3.42
IP(EA), eV:	-10.31(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[3-[4-[(E)-3-(cyclopropylamino)-2-(3-methoxyphenyl)-3-oxoprop-1-enyl]phenyl]prop-2-enoylamino]methyl]-N-hydroxybenzamide

Drug info:

PubChemData

Smile

CCC(=O)C(COC(=O)C)C(=O)OC(C)(C)C

DOS

IR

Vibrations