Geometry & MOs

Info

ID:	132184
PubChem CID:	51316423
Reduced:	NSO3C20H23 (1)
Stoich.:	ABC3D20E23 (1)
Weight, g/mol:	389.231456
ΔH_f, kcal/mol:	-84.49
Dipole, Da:	4.68
IP(EA), eV:	-9.35(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]-2-(3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl)acetamide

Drug info:

PubChemData

Smile

CS(=O)(=O)CC1=CC=C(C=C1)C(=O)NCC2(CCC2)C3=CC=CC=C3

DOS

IR

Vibrations