Geometry & MOs

Info

ID:	304697
PubChem CID:	124766068
Reduced:	S2N3O6C23H31 (1)
Stoich.:	A2B3C6D23E31 (1)
Weight, g/mol:	509.165428
ΔH_f, kcal/mol:	-213.83
Dipole, Da:	4.8
IP(EA), eV:	-8.91(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[4-[[(2R)-butan-2-yl]sulfamoyl]phenyl]sulfonyl-[[(2R)-oxolan-2-yl]methyl]amino]-N-phenylacetamide

Drug info:

PubChemData

Smile

CC[C@H](C)NS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N(C[C@H]2CCCO2)CC(=O)NC3=CC=CC=C3

DOS

IR

Vibrations