Geometry & MOs

Info

ID:	147950
PubChem CID:	53787611
Reduced:	NOC20H25 (1)
Stoich.:	ABC20D25 (1)
Weight, g/mol:	518.179933
ΔH_f, kcal/mol:	-18.04
Dipole, Da:	2.78
IP(EA), eV:	-8.6(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-(4,4-difluorocyclohexyl)-3-(dihydroxycarbamoyl)-1-thiophen-2-ylpentan-2-yl]quinoxaline-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC2=C(CCC2)C=C1CCNCC3=CC=C(C=C3)OC

DOS

IR

Vibrations