Geometry & MOs

Info

ID:	244218
PubChem CID:	99319456
Reduced:	N2O5C20H24 (1)
Stoich.:	A2B5C20D24 (1)
Weight, g/mol:	354.205576
ΔH_f, kcal/mol:	-190.14
Dipole, Da:	7.54
IP(EA), eV:	-9.14(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3R)-1-[5-methyl-1-(3-methylphenyl)pyrazole-4-carbonyl]piperidin-3-yl]propanamide

Drug info:

PubChemData

Smile

CCC(=O)N[C@H]1CCCN(C1)C(=O)COC2=CC3=C(C=C2)OC(=O)C=C3C

DOS

IR

Vibrations