Geometry & MOs

Info

ID:	157732
PubChem CID:	56436841
Reduced:	SN4O4C24H30 (1)
Stoich.:	AB4C4D24E30 (1)
Weight, g/mol:	359.209658
ΔH_f, kcal/mol:	-83.96
Dipole, Da:	7.04
IP(EA), eV:	-9.9(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 4-[methyl-(3,4,7-trimethyl-1-benzofuran-2-carbonyl)amino]butanoate

Drug info:

PubChemData

Smile

CC1=NOC(=N1)CCCNC(=O)C2=CC=C(C=C2)CNS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

DOS

IR

Vibrations