Geometry & MOs

Info

ID:	369788
PubChem CID:	127335280
Reduced:	O2F3N5C17H22 (1)
Stoich.:	A2B3C5D17E22 (1)
Weight, g/mol:	356.221226
ΔH_f, kcal/mol:	-215.24
Dipole, Da:	5.15
IP(EA), eV:	-8.7(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(6-methylpyridazin-3-yl)piperidin-3-yl]-9-oxobicyclo[3.3.1]nonane-3-carboxamide

Drug info:

PubChemData

Smile

CC1=NN=C(C=C1)N2CCCC(C2)NC(=O)C3CC(=O)N(C3)CC(F)(F)F

DOS

IR

Vibrations