Geometry & MOs

Info

ID:	305840
PubChem CID:	124971390
Reduced:	O2N5C23H25 (1)
Stoich.:	A2B5C23D25 (1)
Weight, g/mol:	394.164105
ΔH_f, kcal/mol:	2.41
Dipole, Da:	8.55
IP(EA), eV:	-8.65(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,5-dimethoxyphenyl)-[(2R)-2-(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1=CC(=CC(=N1)[C@H]2CCN(C2)C(=O)C3=NC=C(N=C3)C)NC4=CC=C(C=C4)OC

DOS

IR

Vibrations