Geometry & MOs

Info

ID:	162679
PubChem CID:	57551411
Reduced:	FON4H19C21 (1)
Stoich.:	ABC4D19E21 (1)
Weight, g/mol:	437.190341
ΔH_f, kcal/mol:	-5.83
Dipole, Da:	5.65
IP(EA), eV:	-8.19(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(7-fluoro-2,4-dimethyl-1H-indol-3-yl)ethyl]-4-quinolin-6-ylbenzamide

Drug info:

PubChemData

Smile

CC1=C2C(=C(NC2=C(C=C1)F)C)CCNC(=O)C3=NC4=C(C=CC=N4)C=C3

DOS

IR

Vibrations