Geometry & MOs

Info

ID:	330090
PubChem CID:	127247077
Reduced:	ON5C13H17 (1)
Stoich.:	AB5C13D17 (1)
Weight, g/mol:	260.127326
ΔH_f, kcal/mol:	31.04
Dipole, Da:	2.28
IP(EA), eV:	-9.42(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-ethyl-1,2-oxazol-3-yl)-[3-(1H-pyrazol-5-yl)pyrrolidin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1=CN(N=C1)CC(=O)N2CCC(C2)C3=CC=NN3

DOS

IR

Vibrations