Geometry & MOs

Info

ID:	305605
PubChem CID:	124962003
Reduced:	ON2C10H14 (2)
Stoich.:	AB2C10D14 (2)
Weight, g/mol:	356.221226
ΔH_f, kcal/mol:	-24.39
Dipole, Da:	4.63
IP(EA), eV:	-8.66(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-cyclohexyl-1,2-oxazol-5-yl)-[(3R)-3-(1,4-dimethylimidazol-2-yl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1=CN(C(=N1)[C@H]2CCCN(C2)C(=O)C3=CC(=NO3)C4CCCCC4)C

DOS

IR

Vibrations