Geometry & MOs

Info

ID:	30600
PubChem CID:	841558
Reduced:	SN2O2C14H16 (1)
Stoich.:	AB2C2D14E16 (1)
Weight, g/mol:	281.087435
ΔH_f, kcal/mol:	-34.89
Dipole, Da:	2.6
IP(EA), eV:	-8.67(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1S)-1-phenylethyl]-1-benzothiophene-3-carboxamide

Drug info:

PubChemData

Smile

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CCC3

DOS

IR

Vibrations