Geometry & MOs

Info

ID:	162692
PubChem CID:	57551447
Reduced:	FN2O2H25C27 (1)
Stoich.:	AB2C2D25E27 (1)
Weight, g/mol:	444.196154
ΔH_f, kcal/mol:	-68.18
Dipole, Da:	4.21
IP(EA), eV:	-8.26(-0.83)
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]-5-[3-(methylcarbamoyl)phenyl]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C2C(=C(NC2=C(C=C1)F)C)CCNC(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)C(=O)C

DOS

IR

Vibrations