Geometry & MOs

Info

ID:	157588
PubChem CID:	56435902
Reduced:	O2N4C23H30 (1)
Stoich.:	A2B4C23D30 (1)
Weight, g/mol:	335.180919
ΔH_f, kcal/mol:	-33.01
Dipole, Da:	6.83
IP(EA), eV:	-8.52(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,5-ditert-butylpyrazol-3-yl)-3,5-difluorobenzamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=NN(C(=C1)NC(=O)CCC2=NC=C(O2)C3=CC=CC=C3)C(C)(C)C

DOS

IR

Vibrations