Geometry & MOs

Info

ID:	142326
PubChem CID:	53017216
Reduced:	F2N2O2C13H14 (1)
Stoich.:	A2B2C2D13E14 (1)
Weight, g/mol:	287.14339
ΔH_f, kcal/mol:	-125.51
Dipole, Da:	2.43
IP(EA), eV:	-9.53(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-fluorophenyl)methyl]-5-methyl-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide

Drug info:

PubChemData

Smile

CC1=NOC(C1)(C)CNC(=O)C2=C(C=CC(=C2)F)F

DOS

IR

Vibrations