Geometry & MOs

Info

ID:	368061
PubChem CID:	127327131
Reduced:	ON5C14H17 (1)
Stoich.:	AB5C14D17 (1)
Weight, g/mol:	368.164854
ΔH_f, kcal/mol:	56.03
Dipole, Da:	4.84
IP(EA), eV:	-9.11(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-cyclopropylpyridazin-3-yl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=NN1CC(=O)NC2=NN=C(C=C2)C3CC3)C

DOS

IR

Vibrations