Geometry & MOs

Info

ID:	304491
PubChem CID:	124754293
Reduced:	O3N4H20C22 (1)
Stoich.:	A3B4C20D22 (1)
Weight, g/mol:	287.17461
ΔH_f, kcal/mol:	-38.52
Dipole, Da:	6.49
IP(EA), eV:	-8.97(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-amino-3-methylpyrazol-1-yl)-N-[(1S)-1-(3-methylpyridin-2-yl)propyl]acetamide

Drug info:

PubChemData

Smile

C1CN(CC2=C1N=C(N2)C3=CC=C(C=C3)C(=O)N)C(=O)[C@H]4CC5=CC=CC=C5O4

DOS

IR

Vibrations