Geometry & MOs

Info

ID:	369222
PubChem CID:	127331539
Reduced:	O2N4C15H26 (1)
Stoich.:	A2B4C15D26 (1)
Weight, g/mol:	360.252526
ΔH_f, kcal/mol:	-63.29
Dipole, Da:	3.52
IP(EA), eV:	-9.73(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-tert-butyloxan-3-yl)methyl]-1-pyrazin-2-ylpiperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)C1C(CCCO1)CNC(=O)CCN2C=CN=N2

DOS

IR

Vibrations