Geometry & MOs

Info

ID:	414961
PubChem CID:	135087941
Reduced:	FN4O4C20H21 (1)
Stoich.:	AB4C4D20E21 (1)
Weight, g/mol:	342.194343
ΔH_f, kcal/mol:	-85.04
Dipole, Da:	3.01
IP(EA), eV:	-9.73(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,3-dihydro-1H-inden-5-yloxy)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,2-dimethylpropanamide

Drug info:

PubChemData

Smile

CC1=NOC(=C1)C[C@@H]2CN(C[C@H]2O)C(=O)CCC3=NC(=NO3)C4=CC=CC=C4F

DOS

IR

Vibrations