Geometry & MOs

Info

ID:	343339
PubChem CID:	127266512
Reduced:	N2O3C20H22 (1)
Stoich.:	A2B3C20D22 (1)
Weight, g/mol:	342.194343
ΔH_f, kcal/mol:	-19.78
Dipole, Da:	2.8
IP(EA), eV:	-9.06(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclobutyl-N-[[3-(2-methylmorpholine-4-carbonyl)phenyl]methyl]prop-2-enamide

Drug info:

PubChemData

Smile

CC1=CC=C(O1)C(CNC(=O)C#CC2=CC=CC=C2)N3CCOCC3

DOS

IR

Vibrations