Geometry & MOs

Info

ID:	259305
PubChem CID:	103163813
Reduced:	BrNO2C16H22 (1)
Stoich.:	ABC2D16E22 (1)
Weight, g/mol:	339.08339
ΔH_f, kcal/mol:	-78.99
Dipole, Da:	3.64
IP(EA), eV:	-9.67(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(3-bromophenyl)ethyl]-2-(3-ethoxycyclobutyl)acetamide

Drug info:

PubChemData

Smile

CCOC1CC(C1)CC(=O)NC(C)C2=CC=C(C=C2)Br

DOS

IR

Vibrations