Geometry & MOs

Info

ID:	154909
PubChem CID:	56314458
Reduced:	BrO2N4H17C24 (1)
Stoich.:	AB2C4D17E24 (1)
Weight, g/mol:	375.05824
ΔH_f, kcal/mol:	51.95
Dipole, Da:	7.04
IP(EA), eV:	-9.12(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-bromopyridin-2-yl)-3-(2-methylbutanoylamino)benzamide

Drug info:

PubChemData

Smile

C1=CC2=C(C(=C1)/C=C/C(=O)NC3=CC=CC(=C3)C(=O)NC4=NC=C(C=C4)Br)N=CC=C2

DOS

IR

Vibrations