Geometry & MOs

Info

ID:	202643
PubChem CID:	79703112
Reduced:	BrFOC14H18 (1)
Stoich.:	ABCD14E18 (1)
Weight, g/mol:	375.06161
ΔH_f, kcal/mol:	-88.06
Dipole, Da:	3.42
IP(EA), eV:	-9.84(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-(piperidin-4-ylmethyl)-N-propylpyridine-3-sulfonamide

Drug info:

PubChemData

Smile

C1CCC(CC1)COCC2=CC(=CC(=C2)Br)F

DOS

IR

Vibrations