Geometry & MOs

Info

ID:	367964
PubChem CID:	127326170
Reduced:	N6C19H28 (1)
Stoich.:	A6B19C28 (1)
Weight, g/mol:	362.268176
ΔH_f, kcal/mol:	87.56
Dipole, Da:	6.81
IP(EA), eV:	-8.51(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-tert-butyl-1,2-oxazol-5-yl)-2-[4-(4-methylcyclohexyl)piperazin-1-yl]acetamide

Drug info:

PubChemData

Smile

CC1CCC(CC1)N2CCN(CC2)CC3=NN=NN3C4=CC=CC=C4

DOS

IR

Vibrations