Geometry & MOs

Info

ID:	54127
PubChem CID:	14720325
Reduced:	FNH5C6 (2)
Stoich.:	ABC5D6 (2)
Weight, g/mol:	294.083827
ΔH_f, kcal/mol:	-33.6
Dipole, Da:	2.17
IP(EA), eV:	-8.82(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-fluorophenyl)methyl]-N-(pyridin-4-ylmethyl)methanesulfonamide

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1F)F)NCC2=CC=NC=C2

DOS

IR

Vibrations