Geometry & MOs

Info

ID:	154801
PubChem CID:	56314326
Reduced:	BrO2N6H19C23 (1)
Stoich.:	AB2C6D19E23 (1)
Weight, g/mol:	483.07937
ΔH_f, kcal/mol:	54.78
Dipole, Da:	9.95
IP(EA), eV:	-9.15(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[(5-bromopyridin-2-yl)carbamoyl]phenyl]-2-(2-ethoxyethoxy)benzamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)N2C(=C(N=N2)C(=O)NC3=CC=CC(=C3)C(=O)NC4=NC=C(C=C4)Br)C

DOS

IR

Vibrations