Geometry & MOs

Info

ID:	358418
PubChem CID:	127295963
Reduced:	FSO2N4C17H21 (1)
Stoich.:	ABC2D4E17F21 (1)
Weight, g/mol:	360.241293
ΔH_f, kcal/mol:	-92.23
Dipole, Da:	3.95
IP(EA), eV:	-8.39(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-(cyclohexylmethoxy)phenyl]-1-methyl-1-(oxan-3-ylmethyl)urea

Drug info:

PubChemData

Smile

CC1=NC(=CS1)C(C)NC(=O)NC2=CC(=CC(=C2)F)N3CCOCC3

DOS

IR

Vibrations