Geometry & MOs

Info

ID:	370182
PubChem CID:	127337658
Reduced:	SO2N3C15H29 (1)
Stoich.:	AB2C3D15E29 (1)
Weight, g/mol:	359.268511
ΔH_f, kcal/mol:	-100.26
Dipole, Da:	4.71
IP(EA), eV:	-8.48(0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-3-(3-propan-2-ylcyclohexyl)-1-(1-pyridazin-3-ylpiperidin-3-yl)urea

Drug info:

PubChemData

Smile

CC1C(S(=O)CCN1C(=O)NCCC2CCN(CC2)C)C

DOS

IR

Vibrations