Geometry & MOs

Info

ID:	370279
PubChem CID:	127337946
Reduced:	ON5C21H27 (1)
Stoich.:	AB5C21D27 (1)
Weight, g/mol:	369.227709
ΔH_f, kcal/mol:	8.13
Dipole, Da:	6.99
IP(EA), eV:	-8.41(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1H-imidazol-2-yl)-N-[1-(6-methylpyridazin-3-yl)piperidin-3-yl]piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=NN=C(C=C1)N2CCCC(C2)NC(=O)N3CCCC4=CC=CC=C4C3

DOS

IR

Vibrations