Geometry & MOs

Info

ID:	189048
PubChem CID:	77808856
Reduced:	FSiN2O5C24H46 (1)
Stoich.:	ABC2D5E24F46 (1)
Weight, g/mol:	316.101227
ΔH_f, kcal/mol:	-381.82
Dipole, Da:	2.49
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.753308
Charge, e:	0

Chem-info

IUPAC name:

1-(4-chlorophenyl)-N-[2-(2-methylpyrrolidin-2-yl)ethyl]methanesulfonamide

Drug info:

PubChemData

Smile

CC(C(CC1(CC(CN1C(=O)OC(C)(C)C)C(C)(C)C)O[Si](C)C)F)NC(=O)OC(C)(C)C

DOS

IR

Vibrations