Geometry & MOs

Info

ID:	24943
PubChem CID:	615090
Reduced:	BrNO2C19H22 (1)
Stoich.:	ABC2D19E22 (1)
Weight, g/mol:	375.08339
ΔH_f, kcal/mol:	-56.92
Dipole, Da:	3.89
IP(EA), eV:	-8.68(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-[2-(5-methyl-2-propan-2-ylphenoxy)ethyl]benzamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C(C)C)OCCNC(=O)C2=CC=CC=C2Br

DOS

IR

Vibrations