Geometry & MOs

Info

ID:	130130
PubChem CID:	51075006
Reduced:	FO2N3H14C16 (1)
Stoich.:	AB2C3D14E16 (1)
Weight, g/mol:	339.121906
ΔH_f, kcal/mol:	-27.28
Dipole, Da:	2.7
IP(EA), eV:	-9.39(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(furan-2-ylmethyl)-N-methyl-1H-pyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CN(CC1=CC=CO1)C(=O)C2=C(NN=C2)C3=CC=C(C=C3)F

DOS

IR

Vibrations