Geometry & MOs

Info

ID:	162681
PubChem CID:	57551414
Reduced:	FN3O4C24H24 (1)
Stoich.:	AB3C4D24E24 (1)
Weight, g/mol:	430.180504
ΔH_f, kcal/mol:	-152.44
Dipole, Da:	7.12
IP(EA), eV:	-8.22(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-carbamoylphenyl)-N-[2-(7-fluoro-2,4-dimethyl-1H-indol-3-yl)ethyl]pyridine-4-carboxamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations