Geometry & MOs

Info

ID:	229452
PubChem CID:	87567699
Reduced:	NOC13H23 (1)
Stoich.:	ABC13D23 (1)
Weight, g/mol:	507.136112
ΔH_f, kcal/mol:	-58.57
Dipole, Da:	4.06
IP(EA), eV:	-9.18(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[[4-[(Z)-2-(2-chloro-4-fluorophenyl)-3-(cyclopropylamino)-3-oxoprop-1-enyl]benzoyl]amino]methyl]-N-hydroxybenzamide

Drug info:

PubChemData

Smile

CCCCCCCCC=CC(=O)NC=C

DOS

IR

Vibrations