Geometry & MOs

Info

ID:	288981
PubChem CID:	104329713
Reduced:	FON2C17H19 (1)
Stoich.:	ABC2D17E19 (1)
Weight, g/mol:	286.179361
ΔH_f, kcal/mol:	-67.9
Dipole, Da:	7.13
IP(EA), eV:	-8.56(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,5-dimethylpyrazol-3-yl)-2-methyl-4-(propylamino)benzamide

Drug info:

PubChemData

Smile

CCNC1=CC(=C(C=C1)C(=O)NC2=C(C=C(C=C2)F)C)C

DOS

IR

Vibrations