Geometry & MOs

Info

ID:	357269
PubChem CID:	127293902
Reduced:	SN4O4C18H28 (1)
Stoich.:	AB4C4D18E28 (1)
Weight, g/mol:	378.14741
ΔH_f, kcal/mol:	-158.6
Dipole, Da:	3.4
IP(EA), eV:	-9.04(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4-methyl-1,2,4-triazol-3-yl)methyl]-3-(2-piperidin-1-ylsulfonylphenyl)urea

Drug info:

PubChemData

Smile

C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2NC(=O)NCCN3CCOCC3

DOS

IR

Vibrations