Geometry & MOs

Info

ID:	370056
PubChem CID:	127337305
Reduced:	SN3O4C19H27 (1)
Stoich.:	AB3C4D19E27 (1)
Weight, g/mol:	393.252861
ΔH_f, kcal/mol:	-140.84
Dipole, Da:	6.68
IP(EA), eV:	-9.36(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-3-[(1-phenylcyclopentyl)methyl]-1-(1-pyridazin-3-ylpiperidin-3-yl)urea

Drug info:

PubChemData

Smile

C1CC(CC=C1)NC(=O)NCC2=CC=CC=C2CS(=O)(=O)N3CCOCC3

DOS

IR

Vibrations