Geometry & MOs

Info

ID:	36498
PubChem CID:	8007659
Reduced:	N2O6C19H26 (1)
Stoich.:	A2B6C19D26 (1)
Weight, g/mol:	378.179087
ΔH_f, kcal/mol:	-235.2
Dipole, Da:	5.71
IP(EA), eV:	-8.46(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-(carbamoylamino)-1-oxopropan-2-yl] (E)-3-(4-butoxy-3-ethoxyphenyl)prop-2-enoate

Drug info:

PubChemData

Smile

CCCCOC1=C(C=C(C=C1)/C=C/C(=O)O[C@@H](C)C(=O)NC(=O)N)OCC

DOS

IR

Vibrations