Geometry & MOs

Info

ID:	62804
PubChem CID:	26736949
Reduced:	SN2O5C23H32 (1)
Stoich.:	AB2C5D23E32 (1)
Weight, g/mol:	448.203193
ΔH_f, kcal/mol:	-193.7
Dipole, Da:	3.33
IP(EA), eV:	-8.2(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-(3,4-dimethoxyphenyl)-3-methyl-2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]butanamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1C)S(=O)(=O)N[C@@H](C(C)C)C(=O)NC2=CC(=C(C=C2)OC)OC)C)C

DOS

IR

Vibrations