Geometry & MOs

Info

ID:	60586
PubChem CID:	26697233
Reduced:	FSN2O3H19C21 (1)
Stoich.:	ABC2D3E19F21 (1)
Weight, g/mol:	422.1334
ΔH_f, kcal/mol:	-100.86
Dipole, Da:	3.73
IP(EA), eV:	-8.91(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-(4-ethylphenyl)-2-[(4-methoxyphenyl)sulfonylamino]-4-methylsulfanylbutanamide

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)F

DOS

IR

Vibrations