Geometry & MOs

Info

ID:	369918
PubChem CID:	127336764
Reduced:	SO2F3N3C14H24 (1)
Stoich.:	AB2C3D3E14F24 (1)
Weight, g/mol:	296.184841
ΔH_f, kcal/mol:	-252.81
Dipole, Da:	5.47
IP(EA), eV:	-8.59(0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-hydroxy-2-(oxan-4-yl)ethyl]-3-(1-imidazol-1-ylpropan-2-yl)urea

Drug info:

PubChemData

Smile

CC1C(S(=O)CCN1C(=O)NCC2CCN(C2)CC(F)(F)F)C

DOS

IR

Vibrations