Geometry & MOs

Info

ID:	71055
PubChem CID:	48414228
Reduced:	O3N4C13H22 (1)
Stoich.:	A3B4C13D22 (1)
Weight, g/mol:	356.184841
ΔH_f, kcal/mol:	-128.29
Dipole, Da:	5.31
IP(EA), eV:	-9.45(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-methyl-1H-pyrazol-4-yl)methyl]-1-(2-phenoxyacetyl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCOC(=O)NC(C(C)C)C(=O)NCC1=C(NN=C1)C

DOS

IR

Vibrations