Geometry & MOs

Info

ID:	182811
PubChem CID:	76939844
Reduced:	O2N4H10C13 (1)
Stoich.:	A2B4C10D13 (1)
Weight, g/mol:	259.043378
ΔH_f, kcal/mol:	39.47
Dipole, Da:	6.6
IP(EA), eV:	-9.31(-2.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-chlorothiophen-2-yl)-N-(2-hydroxypropyl)-N-methylprop-2-enamide

Drug info:

PubChemData

Smile

C1=CC2=C(C(=C1)NCC3=CC=CN3)C(=O)N=NC2=O

DOS

IR

Vibrations