Geometry & MOs

Info

ID:	241071
PubChem CID:	93621538
Reduced:	O2N5C18H27 (1)
Stoich.:	A2B5C18D27 (1)
Weight, g/mol:	304.189926
ΔH_f, kcal/mol:	-73.95
Dipole, Da:	2.92
IP(EA), eV:	-9.11(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopentyloxy-N-[(3R)-1-pyrimidin-2-ylpiperidin-3-yl]acetamide

Drug info:

PubChemData

Smile

CC(C)CN1C[C@H](CC1=O)C(=O)N[C@H]2CCCN(C2)C3=NC=CC=N3

DOS

IR

Vibrations