Geometry & MOs

Info

ID:	286653
PubChem CID:	104179608
Reduced:	NSC12H25 (1)
Stoich.:	ABC12D25 (1)
Weight, g/mol:	269.11757
ΔH_f, kcal/mol:	-37.6
Dipole, Da:	2.36
IP(EA), eV:	-8.5(0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-fluoro-N-[3-(2-methoxyethylamino)-3-oxopropyl]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CCSCCCNC(C)C1CCCC1

DOS

IR

Vibrations