Geometry & MOs

Info

ID:	370333
PubChem CID:	127338105
Reduced:	SN3O5C17H31 (1)
Stoich.:	AB3C5D17E31 (1)
Weight, g/mol:	387.219178
ΔH_f, kcal/mol:	-240.37
Dipole, Da:	6.1
IP(EA), eV:	-9.4(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopentyl-1-ethyl-3-[1-(oxan-4-ylsulfonyl)piperidin-4-yl]urea

Drug info:

PubChemData

Smile

CC1CN(CCCO1)C(=O)NC2CCN(CC2)S(=O)(=O)C3CCOCC3

DOS

IR

Vibrations