Geometry & MOs

Info

ID:	194311
PubChem CID:	78514075
Reduced:	NO7H21C22 (1)
Stoich.:	AB7C21D22 (1)
Weight, g/mol:	374.147786
ΔH_f, kcal/mol:	-224.48
Dipole, Da:	9.07
IP(EA), eV:	-9.08(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(4-carbamoylpiperidin-1-yl)-2-oxoethyl] 3-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-enoate

Drug info:

PubChemData

Smile

COC(=O)C1=CC=C(C=C1)CNC(=O)COC(=O)C=CC2=CC3=C(C=C2)OCCO3

DOS

IR

Vibrations