Geometry & MOs

Info

ID:	192528
PubChem CID:	78280910
Reduced:	NO5C20H21 (1)
Stoich.:	AB5C20D21 (1)
Weight, g/mol:	368.100836
ΔH_f, kcal/mol:	-158.12
Dipole, Da:	6.02
IP(EA), eV:	-8.64(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(2-benzoylhydrazinyl)-2-oxoethyl] 3-(1,3-benzodioxol-5-yl)prop-2-enoate

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)NC(=O)COC(=O)C=CC2=CC(=C(C=C2)O)OC

DOS

IR

Vibrations