Geometry & MOs

Info

ID:	58354
PubChem CID:	24697958
Reduced:	SF2N2O2H10C13 (1)
Stoich.:	AB2C2D2E10F13 (1)
Weight, g/mol:	283.02079
ΔH_f, kcal/mol:	-112.61
Dipole, Da:	6.2
IP(EA), eV:	-8.28(-1.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-bromophenyl)-(2-methylmorpholin-4-yl)methanone

Drug info:

PubChemData

Smile

CC1=C(C(=S)N=C(N1)C2=CC(=CC(=C2)F)F)C(=O)OC

DOS

IR

Vibrations