Geometry & MOs

Info

ID:	130636
PubChem CID:	51091841
Reduced:	ON6C18H18 (1)
Stoich.:	AB6C18D18 (1)
Weight, g/mol:	334.115127
ΔH_f, kcal/mol:	78.25
Dipole, Da:	6.64
IP(EA), eV:	-8.63(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-acetamido-2-fluoro-N-methyl-N-[1-(5-methylthiophen-2-yl)ethyl]benzamide

Drug info:

PubChemData

Smile

C1CN(C2=CC=CC=C21)CCNC(=O)C3=CC(=NC=C3)N4C=NC=N4

DOS

IR

Vibrations