Geometry & MOs

Info

ID:	370338
PubChem CID:	127338110
Reduced:	SN3O5C17H31 (1)
Stoich.:	AB3C5D17E31 (1)
Weight, g/mol:	389.198442
ΔH_f, kcal/mol:	-238.57
Dipole, Da:	8.07
IP(EA), eV:	-9.31(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-cyclopropyl-2-hydroxypropyl)-3-[1-(oxan-4-ylsulfonyl)piperidin-4-yl]urea

Drug info:

PubChemData

Smile

CN(CC1CCCO1)C(=O)NC2CCN(CC2)S(=O)(=O)C3CCOCC3

DOS

IR

Vibrations