Geometry & MOs

Info

ID:	361138
PubChem CID:	127302082
Reduced:	O3N6C19H28 (1)
Stoich.:	A3B6C19D28 (1)
Weight, g/mol:	368.221226
ΔH_f, kcal/mol:	-83.36
Dipole, Da:	2.73
IP(EA), eV:	-8.83(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-phenyl-N-[(4-piperidin-1-yloxan-4-yl)methyl]-1H-pyrazole-5-carboxamide

Drug info:

PubChemData

Smile

CN1C2=C(C=N1)C(=O)N(C=N2)CC(=O)NCC3(CCOCC3)N4CCCCC4

DOS

IR

Vibrations