Geometry & MOs

Info

ID:	198856
PubChem CID:	79162879
Reduced:	ON3C15H29 (1)
Stoich.:	AB3C15D29 (1)
Weight, g/mol:	310.0117
ΔH_f, kcal/mol:	-80.39
Dipole, Da:	3.56
IP(EA), eV:	-9.08(1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5-bromo-2-fluoroanilino)methyl]-6-methylpyridin-3-ol

Drug info:

PubChemData

Smile

CC1CCCN(C1)C(=O)N(CCN)C2CCCCC2

DOS

IR

Vibrations