Geometry & MOs

Info

ID:	197529
PubChem CID:	78974700
Reduced:	FN2C17H27 (1)
Stoich.:	AB2C17D27 (1)
Weight, g/mol:	294.082684
ΔH_f, kcal/mol:	-29.84
Dipole, Da:	2.54
IP(EA), eV:	-8.5(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-cyanophenyl)-N-methyl-2,3-dihydro-1-benzothiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)CCN(C1CC1)C(C2=CC=CC=C2F)C(C)N

DOS

IR

Vibrations