Geometry & MOs

Info

ID:	30601
PubChem CID:	841559
Reduced:	NOSH15C17 (1)
Stoich.:	ABCD15E17 (1)
Weight, g/mol:	281.087435
ΔH_f, kcal/mol:	17.23
Dipole, Da:	3.13
IP(EA), eV:	-8.85(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C[C@@H](C1=CC=CC=C1)NC(=O)C2=CSC3=CC=CC=C32

DOS

IR

Vibrations