Geometry & MOs

Info

ID:	69190
PubChem CID:	46530390
Reduced:	BrN3O3H18C23 (1)
Stoich.:	AB3C3D18E23 (1)
Weight, g/mol:	478.08921
ΔH_f, kcal/mol:	-29.85
Dipole, Da:	3.31
IP(EA), eV:	-8.23(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-bromobenzoyl)-N-[4-(diethylcarbamoyl)phenyl]benzamide

Drug info:

PubChemData

Smile

C1CN(C(=O)N1)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3C(=O)C4=CC=C(C=C4)Br

DOS

IR

Vibrations