Geometry & MOs

Info

ID:	346873
PubChem CID:	127271377
Reduced:	SO2N6C17H28 (1)
Stoich.:	AB2C6D17E28 (1)
Weight, g/mol:	377.231456
ΔH_f, kcal/mol:	-47.76
Dipole, Da:	5.22
IP(EA), eV:	-9.34(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-N-[1-(2-methylpiperidin-1-yl)-1-oxopropan-2-yl]propanamide

Drug info:

PubChemData

Smile

CC1CCCCN1C(=O)C(C)NC(=O)CSC2=NN=NN2C3CCCC3

DOS

IR

Vibrations