Geometry & MOs

Info

ID:	184850
PubChem CID:	77220252
Reduced:	SN2O5C20H32 (1)
Stoich.:	AB2C5D20E32 (1)
Weight, g/mol:	508.128916
ΔH_f, kcal/mol:	-242.91
Dipole, Da:	1.72
IP(EA), eV:	-9.83(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-N'-[3-[3-fluoro-4-(4-methylimidazol-1-yl)phenyl]prop-2-enoyl]-2-(3,4,5-trifluorophenyl)pentanehydrazide

Drug info:

PubChemData

Smile

CCOC(=O)C1=CSC(=N1)C(CC(C2CCCCC2)NC(=O)OC(C)(C)C)O

DOS

IR

Vibrations