Geometry & MOs

Info

ID:	359270
PubChem CID:	127297866
Reduced:	FSN3O4C18H26 (1)
Stoich.:	ABC3D4E18F26 (1)
Weight, g/mol:	395.220892
ΔH_f, kcal/mol:	-207.92
Dipole, Da:	9.68
IP(EA), eV:	-9.17(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,4-dihydro-2H-chromen-4-ylmethyl)-3-[2-(2,6-dimethylmorpholin-4-yl)phenyl]urea

Drug info:

PubChemData

Smile

CC1(CCCC1)CNC(=O)NC2=CC(=C(C=C2)F)S(=O)(=O)N3CCOCC3

DOS

IR

Vibrations