Geometry & MOs

Info

ID:	131007
PubChem CID:	51143659
Reduced:	NF2O5C19H19 (1)
Stoich.:	AB2C5D19E19 (1)
Weight, g/mol:	360.071468
ΔH_f, kcal/mol:	-246.96
Dipole, Da:	2.86
IP(EA), eV:	-8.9(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-N'-(2-methylsulfanylacetyl)-1-phenylthieno[2,3-c]pyrazole-5-carbohydrazide

Drug info:

PubChemData

Smile

CN(CC1=CC(=C(C=C1)OC(F)F)OC)C(=O)C2COC3=CC=CC=C3O2

DOS

IR

Vibrations