Geometry & MOs

Info

ID:	413151
PubChem CID:	135086095
Reduced:	ClSO3H13C15 (1)
Stoich.:	ABC3D13E15 (1)
Weight, g/mol:	291.147058
ΔH_f, kcal/mol:	-78.46
Dipole, Da:	5.72
IP(EA), eV:	-9.48(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methoxy-N-methyl-2-(2-phenylmethoxyacetyl)pent-4-enamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)C(C=O)C2=CC=C(C=C2)Cl

DOS

IR

Vibrations