Geometry & MOs

Info

ID:	130735
PubChem CID:	51097886
Reduced:	NO4C20H27 (1)
Stoich.:	AB4C20D27 (1)
Weight, g/mol:	333.168856
ΔH_f, kcal/mol:	-119.14
Dipole, Da:	4.0
IP(EA), eV:	-8.58(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[benzyl-[2-oxo-2-(prop-2-enylcarbamoylamino)ethyl]amino]propanoate

Drug info:

PubChemData

Smile

CCOC1=CC=CC(=C1)C(C)NCC2=C(C(=C(C=C2)OC)OC)OC

DOS

IR

Vibrations