Geometry & MOs

Info

ID:	36973
PubChem CID:	8015554
Reduced:	NSF2O4C17H21 (1)
Stoich.:	ABC2D4E17F21 (1)
Weight, g/mol:	419.151492
ΔH_f, kcal/mol:	-251.98
Dipole, Da:	5.0
IP(EA), eV:	-9.03(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5-acetamido-2-methoxyphenyl)sulfonylamino]-N-[(2R)-butan-2-yl]benzamide

Drug info:

PubChemData

Smile

CC1([C@H]2CC[C@@]1(C(=O)C2)CS(=O)(=O)NC3=CC=C(C=C3)OC(F)F)C

DOS

IR

Vibrations