Geometry & MOs

Info

ID:	195217
PubChem CID:	78656225
Reduced:	N3O6C20H23 (1)
Stoich.:	A3B6C20D23 (1)
Weight, g/mol:	387.143035
ΔH_f, kcal/mol:	-227.77
Dipole, Da:	1.21
IP(EA), eV:	-10.11(-2.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-oxo-1-(propan-2-ylcarbamoylamino)propan-2-yl] 1,3-dioxo-2-prop-2-enylisoindole-5-carboxylate

Drug info:

PubChemData

Smile

CC(C(=O)NC(=O)NC(C)(C)C)OC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)CC=C

DOS

IR

Vibrations