Geometry & MOs

Info

ID:	367067
PubChem CID:	127323052
Reduced:	ON5C19H23 (1)
Stoich.:	AB5C19D23 (1)
Weight, g/mol:	341.210327
ΔH_f, kcal/mol:	7.18
Dipole, Da:	2.0
IP(EA), eV:	-8.88(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CCN(CC1)C2=NC=NC(=C2)NC3CC(=O)N(C3)C4=CC=CC=C4

DOS

IR

Vibrations