Geometry & MOs

Info

ID:	357371
PubChem CID:	127294004
Reduced:	O2N3C24H31 (1)
Stoich.:	A2B3C24D31 (1)
Weight, g/mol:	347.184506
ΔH_f, kcal/mol:	-56.4
Dipole, Da:	5.57
IP(EA), eV:	-8.84(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-3-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)propanamide

Drug info:

PubChemData

Smile

CC1=C(N(N=C1C(C)(C)C)C2=CC=CC=C2)NC(=O)C3CC4CCCC(C3)C4=O

DOS

IR

Vibrations