Geometry & MOs

Info

ID:	368745
PubChem CID:	127329996
Reduced:	OSN4C18H30 (1)
Stoich.:	ABC4D18E30 (1)
Weight, g/mol:	366.208947
ΔH_f, kcal/mol:	-53.91
Dipole, Da:	7.14
IP(EA), eV:	-8.63(0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-N-(3-methylsulfanylcyclohexyl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC(C)C1=NC2=C(N1C)CCN(C2)C(=O)NC3CCCC(C3)SC

DOS

IR

Vibrations