Geometry & MOs

Info

ID:	375768
PubChem CID:	134221758
Reduced:	FSO2C10H13 (1)
Stoich.:	ABC2D10E13 (1)
Weight, g/mol:	403.210721
ΔH_f, kcal/mol:	-106.8
Dipole, Da:	5.82
IP(EA), eV:	-8.52(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(4-hydrazinyl-3,3-dimethyl-4-oxobutoxy)-3-methylbutyl]-2-oxochromene-3-carboxamide

Drug info:

PubChemData

Smile

CS(=O)C1=CC=C(C=C1)C(CCF)O

DOS

IR

Vibrations