Geometry & MOs

Info

ID:	30384
PubChem CID:	841236
Reduced:	NOSC15H17 (1)
Stoich.:	ABCD15E17 (1)
Weight, g/mol:	259.103085
ΔH_f, kcal/mol:	-9.93
Dipole, Da:	4.3
IP(EA), eV:	-9.22(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1S)-1-(4-ethylphenyl)ethyl]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)[C@@H](C)NC(=O)C2=CC=CS2

DOS

IR

Vibrations