Geometry & MOs

Info

ID:	32729
PubChem CID:	7847425
Reduced:	NSO2C20H25 (1)
Stoich.:	ABC2D20E25 (1)
Weight, g/mol:	392.122835
ΔH_f, kcal/mol:	-62.53
Dipole, Da:	5.39
IP(EA), eV:	-8.4(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-(4-tert-butylphenyl)sulfanyl-N-(4-sulfamoylphenyl)propanamide

Drug info:

PubChemData

Smile

C[C@H](C(=O)NC1=CC=CC=C1OC)SC2=CC=C(C=C2)C(C)(C)C

DOS

IR

Vibrations