Geometry & MOs

Info

ID:	30606
PubChem CID:	841564
Reduced:	NOC7H9 (2)
Stoich.:	ABC7D9 (2)
Weight, g/mol:	246.111676
ΔH_f, kcal/mol:	-26.05
Dipole, Da:	4.88
IP(EA), eV:	-8.66(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1,5-dimethylpyrazol-4-yl)methylideneamino]-2-methylfuran-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)OC1=CC=CC=C1C=NNC(=O)C2CC2

DOS

IR

Vibrations