Geometry & MOs

Info

ID:	369344
PubChem CID:	127332372
Reduced:	S2N3O3C13H25 (1)
Stoich.:	A2B3C3D13E25 (1)
Weight, g/mol:	361.203528
ΔH_f, kcal/mol:	-160.02
Dipole, Da:	3.45
IP(EA), eV:	-8.49(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-cycloheptyloxyethyl)-3-(1-methylsulfonylpiperidin-3-yl)urea

Drug info:

PubChemData

Smile

CC1C(SCCN1C(=O)NC2CCCN(C2)S(=O)(=O)C)C

DOS

IR

Vibrations