Geometry & MOs

Info

ID:	179265
PubChem CID:	76458590
Reduced:	N2O3C16H20 (1)
Stoich.:	A2B3C16D20 (1)
Weight, g/mol:	312.158626
ΔH_f, kcal/mol:	-108.29
Dipole, Da:	6.39
IP(EA), eV:	-9.48(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-benzylpyrazol-4-yl)methyl]-6-oxopiperidine-3-carboxamide

Drug info:

PubChemData

Smile

C1CC(=O)NCC1C(=O)N2CCOC(C2)C3=CC=CC=C3

DOS

IR

Vibrations