Geometry & MOs

Info

ID:	154056
PubChem CID:	56313435
Reduced:	BrFO3N4H16C22 (1)
Stoich.:	ABC3D4E16F22 (1)
Weight, g/mol:	443.03031
ΔH_f, kcal/mol:	-30.9
Dipole, Da:	5.54
IP(EA), eV:	-9.32(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[(5-bromopyridin-2-yl)carbamoyl]phenyl]-4-ethyl-5-methylthiophene-2-carboxamide

Drug info:

PubChemData

Smile

C1C(ON=C1C2=CC(=CC=C2)F)C(=O)NC3=CC=CC(=C3)C(=O)NC4=NC=C(C=C4)Br

DOS

IR

Vibrations