Geometry & MOs

Info

ID:	162712
PubChem CID:	57551550
Reduced:	FO3N4C25H27 (1)
Stoich.:	AB3C4D25E27 (1)
Weight, g/mol:	416.126024
ΔH_f, kcal/mol:	-110.96
Dipole, Da:	4.37
IP(EA), eV:	-8.22(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[7-fluoro-2-methyl-4-(trifluoromethyl)-1H-indol-3-yl]ethyl]quinoxaline-6-carboxamide

Drug info:

PubChemData

Smile

CC1=C2C(=C(NC2=C(C=C1)F)C)CCNC(=O)C3=CC4=C(N3)C=CC(=C4)OCC(=O)N(C)C

DOS

IR

Vibrations