Geometry & MOs

Info

ID:	179293
PubChem CID:	76462156
Reduced:	BrSi2O5N6C25H45 (1)
Stoich.:	AB2C5D6E25F45 (1)
Weight, g/mol:	345.139865
ΔH_f, kcal/mol:	-288.85
Dipole, Da:	2.4
IP(EA), eV:	-8.89(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-benzyl-2-methyl-4-(4-methylphenyl)sulfonylmorpholine

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C)(C)OC1C(OC(C1O[Si](C)(C)C(C)(C)C)N2C3=NC=NC(=C3N=C2Br)N)CNCC(=O)OC

DOS

IR

Vibrations