Geometry & MOs

Info

ID:	305884
PubChem CID:	124972606
Reduced:	O3N4C19H20 (1)
Stoich.:	A3B4C19D20 (1)
Weight, g/mol:	457.257671
ΔH_f, kcal/mol:	-35.68
Dipole, Da:	3.86
IP(EA), eV:	-8.85(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohexyl-3-[(3R)-1-[(3,4,5-trimethoxyphenyl)methyl]piperidin-3-yl]-1,2-oxazole-5-carboxamide

Drug info:

PubChemData

Smile

CC1=CN=C2N1C[C@H](N(C2)C(=O)C3=C(OC=N3)C)C4=CC(=CC=C4)OC

DOS

IR

Vibrations