Geometry & MOs

Info

ID:	447171
PubChem CID:	135280917
Reduced:	SO2C16H28 (1)
Stoich.:	AB2C16D28 (1)
Weight, g/mol:	276.038236
ΔH_f, kcal/mol:	-135.8
Dipole, Da:	5.82
IP(EA), eV:	-8.55(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-(1,3-dioxo-4,7-epoxyisoindol-2-yl)acetyl]amino]acetic acid

Drug info:

PubChemData

Smile

CCC(=O)CC1CC(SC1)CCCCC(=O)C(C)C

DOS

IR

Vibrations