Geometry & MOs

Info

ID:	78283
PubChem CID:	49684264
Reduced:	FSO2N3C18H24 (1)
Stoich.:	ABC2D3E18F24 (1)
Weight, g/mol:	366.172562
ΔH_f, kcal/mol:	-83.38
Dipole, Da:	4.76
IP(EA), eV:	-8.53(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-dimethyl-N-[[1-[(1-methylpyrrol-2-yl)methyl]piperidin-4-yl]methyl]-1,2-oxazole-4-sulfonamide

Drug info:

PubChemData

Smile

CN1C=CC=C1CN2CCC(CC2)CNS(=O)(=O)C3=CC=CC(=C3)F

DOS

IR

Vibrations