Geometry & MOs

Info

ID:	352342
PubChem CID:	127283426
Reduced:	N2O2C9H14 (2)
Stoich.:	A2B2C9D14 (2)
Weight, g/mol:	392.20597
ΔH_f, kcal/mol:	-193.46
Dipole, Da:	8.63
IP(EA), eV:	-9.26(0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[3-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)propanoylamino]acetyl]-N-methylpyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CNC(=O)C1CCCN1C(=O)CNC(=O)C2CC(=O)N(C2)C3CCCC3

DOS

IR

Vibrations