Geometry & MOs

Info

ID:	362910
PubChem CID:	127309748
Reduced:	ON5C21H23 (1)
Stoich.:	AB5C21D23 (1)
Weight, g/mol:	354.205576
ΔH_f, kcal/mol:	39.76
Dipole, Da:	1.48
IP(EA), eV:	-8.78(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dihydro-1H-inden-1-ylmethyl)-4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

C1CC2=CC=CC=C2C1CNC(=O)N3CCN(CC3)C4=C(C=CC=N4)C#N

DOS

IR

Vibrations