Geometry & MOs

Info

ID:	136609
PubChem CID:	52073804
Reduced:	N3O5C22H31 (1)
Stoich.:	A3B5C22D31 (1)
Weight, g/mol:	437.267842
ΔH_f, kcal/mol:	-155.25
Dipole, Da:	6.42
IP(EA), eV:	-8.45(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(cyclohexen-1-yl)ethyl]-1-[[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(N=C(O1)C2=C(C(=CC=C2)OC)OC)CN3CCC(CC3)C(=O)NCCOC

DOS

IR

Vibrations