Geometry & MOs

Info

ID:	365380
PubChem CID:	127317779
Reduced:	FO3N4C21H23 (1)
Stoich.:	AB3C4D21E23 (1)
Weight, g/mol:	377.177313
ΔH_f, kcal/mol:	-133.45
Dipole, Da:	6.92
IP(EA), eV:	-8.29(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3-methyloxolan-3-yl)methyl]-3-[4-(2-oxo-2-thiomorpholin-4-ylethyl)phenyl]urea

Drug info:

PubChemData

Smile

CC(=O)N1CCC2=C1C=CC(=C2)NC(=O)NC3=CC(=CC(=C3)F)N4CCOCC4

DOS

IR

Vibrations