Geometry & MOs

Info

ID:	371278
PubChem CID:	127344648
Reduced:	O2N5C19H33 (1)
Stoich.:	A2B5C19D33 (1)
Weight, g/mol:	376.283826
ΔH_f, kcal/mol:	-90.1
Dipole, Da:	5.03
IP(EA), eV:	-9.45(0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-tert-butyloxan-3-yl)methyl]-4-(1-ethylpyrazol-4-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC(C)C1=NN2CC(CCC2=N1)NC(=O)NCCOC3CCCCCC3

DOS

IR

Vibrations