Geometry & MOs

Info

ID:	131738
PubChem CID:	51256316
Reduced:	NO5C17H23 (1)
Stoich.:	AB5C17D23 (1)
Weight, g/mol:	305.162708
ΔH_f, kcal/mol:	-186.08
Dipole, Da:	4.09
IP(EA), eV:	-8.68(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-2-yl 3-[[(E)-3-(2-ethoxyphenyl)prop-2-enoyl]amino]propanoate

Drug info:

PubChemData

Smile

CC(C)OC(=O)CCNC(=O)/C=C/C1=C(C=CC(=C1)OC)OC

DOS

IR

Vibrations