Geometry & MOs

Info

ID:	135265
PubChem CID:	51844252
Reduced:	SN2O5C28H34 (1)
Stoich.:	AB2C5D28E34 (1)
Weight, g/mol:	510.218843
ΔH_f, kcal/mol:	-168.15
Dipole, Da:	7.81
IP(EA), eV:	-9.23(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-methylfuran-2-yl)methyl]-N-[(1R)-1-(4-methylphenyl)-2-[(4-methylphenyl)sulfonylmethylamino]-2-oxoethyl]pentanamide

Drug info:

PubChemData

Smile

CCCCC(=O)N(CC1=CC=C(O1)C)[C@@H](C2=CC=C(C=C2)C)C(=O)NCS(=O)(=O)C3=CC=C(C=C3)C

DOS

IR

Vibrations