Geometry & MOs

Info

ID:	369489
PubChem CID:	127334209
Reduced:	SN2O3C18H24 (1)
Stoich.:	AB2C3D18E24 (1)
Weight, g/mol:	327.180758
ΔH_f, kcal/mol:	-103.7
Dipole, Da:	8.07
IP(EA), eV:	-9.6(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohex-3-en-1-yl-1-(tetrazolo[1,5-b]pyridazin-6-yl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

C1CC(CC=C1)NC(=O)C2=CC=CC(=C2)CN3CCS(=O)(=O)CC3

DOS

IR

Vibrations