Geometry & MOs

Info

ID:	371340
PubChem CID:	127345768
Reduced:	O2N3C10H15 (1)
Stoich.:	A2B3C10D15 (1)
Weight, g/mol:	292.153541
ΔH_f, kcal/mol:	-52.16
Dipole, Da:	2.02
IP(EA), eV:	-8.71(0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[2-(cyclopropylamino)-2-oxoethyl]pyrazol-4-yl]-2-(oxolan-3-yl)acetamide

Drug info:

PubChemData

Smile

CN1C=C(C=N1)NC(=O)CC2CCOC2

DOS

IR

Vibrations