Geometry & MOs

Info

ID:	137920
PubChem CID:	52283947
Reduced:	FN3O3C23H30 (1)
Stoich.:	AB3C3D23E30 (1)
Weight, g/mol:	415.22712
ΔH_f, kcal/mol:	-139.34
Dipole, Da:	4.18
IP(EA), eV:	-8.91(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-[(3-fluorophenoxy)methyl]phenyl]-3-[(2R)-2-methyl-2-morpholin-4-ylbutyl]urea

Drug info:

PubChemData

Smile

CC[C@@](C)(CNC(=O)NC1=CC=CC(=C1)COC2=CC(=CC=C2)F)N3CCOCC3

DOS

IR

Vibrations