Geometry & MOs

Info

ID:	129934
PubChem CID:	51074310
Reduced:	OSN3C12H15 (1)
Stoich.:	ABC3D12E15 (1)
Weight, g/mol:	273.111341
ΔH_f, kcal/mol:	21.05
Dipole, Da:	2.01
IP(EA), eV:	-9.03(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-benzodioxol-5-ylmethyl)-N-methyl-2-pyrazol-1-ylacetamide

Drug info:

PubChemData

Smile

CC1=C(SC=C1)CN(C)C(=O)CN2C=CC=N2

DOS

IR

Vibrations