Geometry & MOs

Info

ID:	79271
PubChem CID:	49747746
Reduced:	O2N3C18H23 (1)
Stoich.:	A2B3C18D23 (1)
Weight, g/mol:	356.155849
ΔH_f, kcal/mol:	-20.2
Dipole, Da:	3.81
IP(EA), eV:	-9.15(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-[2-(4-methylphenyl)-2-morpholin-4-ylethyl]-3-thiophen-3-ylprop-2-enamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(CNC(=O)C2(CC2)C#N)N3CCOCC3

DOS

IR

Vibrations