Geometry & MOs

Info

ID:	324067
PubChem CID:	126676869
Reduced:	ON6C21H28 (1)
Stoich.:	AB6C21D28 (1)
Weight, g/mol:	180.069891
ΔH_f, kcal/mol:	28.7
Dipole, Da:	4.2
IP(EA), eV:	-7.91(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-fluoro-3-methylidene-2,4-dihydro-1H-quinoxalin-2-ol

Drug info:

PubChemData

Smile

CC1=NC(=NC=C1/C=C(\C)/C(=O)N(C)C)NC2=CC=C(C=C2)N3CCNCC3

DOS

IR

Vibrations