Geometry & MOs

Info

ID:	343016
PubChem CID:	127266179
Reduced:	O2N3C16H23 (1)
Stoich.:	A2B3C16D23 (1)
Weight, g/mol:	303.194677
ΔH_f, kcal/mol:	-72.79
Dipole, Da:	3.39
IP(EA), eV:	-9.29(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3R)-3-aminopiperidin-1-yl]-(2-cyclohexyloxypyridin-4-yl)methanone

Drug info:

PubChemData

Smile

C1CCC(CC1)OC2=NC=CC(=C2)C(=O)N3CC[C@H](C3)N

DOS

IR

Vibrations