Geometry & MOs

Info

ID:	291551
PubChem CID:	113438570
Reduced:	ClON2C14H15 (1)
Stoich.:	ABC2D14E15 (1)
Weight, g/mol:	265.142641
ΔH_f, kcal/mol:	2.66
Dipole, Da:	4.92
IP(EA), eV:	-9.12(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-5-methyl-3-[(pyridazine-4-carbonylamino)methyl]hexanoic acid

Drug info:

PubChemData

Smile

CCCOC1=CC=CC=C1C2=C(C(=NC=N2)Cl)C

DOS

IR

Vibrations