Geometry & MOs

Info

ID:	216764
PubChem CID:	85086741
Reduced:	FN2O2C17H17 (1)
Stoich.:	AB2C2D17E17 (1)
Weight, g/mol:	300.138639
ΔH_f, kcal/mol:	-65.44
Dipole, Da:	2.54
IP(EA), eV:	-8.65(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-azabicyclo[2.2.1]heptan-3-yl)-4-(3-fluorophenyl)pyrazole-1-carboxamide

Drug info:

PubChemData

Smile

CCOC(=O)C(=NNC1=CC=CC=C1)CC2=CC=C(C=C2)F

DOS

IR

Vibrations