Geometry & MOs

Info

ID:	145539
PubChem CID:	53541959
Reduced:	O3N4C15H22 (1)
Stoich.:	A3B4C15D22 (1)
Weight, g/mol:	342.205576
ΔH_f, kcal/mol:	-63.12
Dipole, Da:	5.06
IP(EA), eV:	-8.56(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-(3-methylbutan-2-yl)-1,3-dihydroisoindol-4-yl]amino]-N-(3-methyl-1,2-oxazol-5-yl)acetamide

Drug info:

PubChemData

Smile

C1CCOC(C1)ONC(=O)C2CCCN(C2)C3=NC=CN=C3

DOS

IR

Vibrations