Geometry & MOs

Info

ID:	308473
PubChem CID:	125333190
Reduced:	N3O3H17C18 (1)
Stoich.:	A3B3C17D18 (1)
Weight, g/mol:	323.126991
ΔH_f, kcal/mol:	-14.74
Dipole, Da:	5.48
IP(EA), eV:	-8.79(-1.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-(4-methoxynaphthalen-1-yl)-3-(3-methyl-5-oxopyrazol-4-yl)propanamide

Drug info:

PubChemData

Smile

CC1=C(C(=O)N=N1)[C@@H](CC(=O)N)C2=CC=C(C3=CC=CC=C32)OC

DOS

IR

Vibrations