Geometry & MOs

Info

ID:	318104
PubChem CID:	126648971
Reduced:	O5C28H52 (1)
Stoich.:	A5B28C52 (1)
Weight, g/mol:	487.152555
ΔH_f, kcal/mol:	-307.21
Dipole, Da:	5.07
IP(EA), eV:	-9.45(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[4-[2-[4-[3-(hydroxycarbamoyl)-1,2-oxazol-5-yl]butanoylamino]-1,3-thiazol-4-yl]phenyl]carbamate

Drug info:

PubChemData

Smile

CCCCC/C=C/CCCC/C=C/CCC(CCCC(CC(CCCCCC(=O)O)O)O)O

DOS

IR

Vibrations