Geometry & MOs

Info

ID:	20916
PubChem CID:	586303
Reduced:	NOSC15H15 (1)
Stoich.:	ABCD15E15 (1)
Weight, g/mol:	257.087435
ΔH_f, kcal/mol:	10.34
Dipole, Da:	3.73
IP(EA), eV:	-8.93(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,6-dimethylphenyl)-3-thiophen-2-ylprop-2-enamide

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C)NC(=O)C=CC2=CC=CS2

DOS

IR

Vibrations