Geometry & MOs

Info

ID:	370287
PubChem CID:	127337956
Reduced:	ON5C21H33 (1)
Stoich.:	AB5C21D33 (1)
Weight, g/mol:	351.20591
ΔH_f, kcal/mol:	-13.66
Dipole, Da:	7.09
IP(EA), eV:	-8.41(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(6-methylpyridazin-3-yl)piperidin-3-yl]-2-phenylazetidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=NN=C(C=C1)N2CCCC(C2)NC(=O)N(CC3CCCCC3)C4CC4

DOS

IR

Vibrations