Geometry & MOs

Info

ID:	438870
PubChem CID:	135228629
Reduced:	FSN4O5C23H23 (1)
Stoich.:	ABC4D5E23F23 (1)
Weight, g/mol:	425.30825
ΔH_f, kcal/mol:	-175.62
Dipole, Da:	7.66
IP(EA), eV:	-8.96(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC1=C(SC2=C1C(=O)N(C(=O)N2CCC3=C(C=CC(=C3)F)OC)C(C)(C)C(=O)O)N4C=CC=N4

DOS

IR

Vibrations