Geometry & MOs

Info

ID:	78401
PubChem CID:	49689469
Reduced:	SN3O3C16H19 (1)
Stoich.:	AB3C3D16E19 (1)
Weight, g/mol:	333.205242
ΔH_f, kcal/mol:	-45.6
Dipole, Da:	2.19
IP(EA), eV:	-9.44(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(5-methyl-1,2-oxazole-3-carbonyl)piperidin-4-yl]methyl]cyclohexanecarboxamide

Drug info:

PubChemData

Smile

CC1=CC(=NO1)C(=O)N2CCC(CC2)CNC(=O)C3=CSC=C3

DOS

IR

Vibrations