Geometry & MOs

Info

ID:	209364
PubChem CID:	80659764
Reduced:	BrON2C14H17 (1)
Stoich.:	ABC2D14E17 (1)
Weight, g/mol:	303.11978
ΔH_f, kcal/mol:	-8.6
Dipole, Da:	6.89
IP(EA), eV:	-9.48(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-bromoethyl)-N-butyl-2,2,3,3-tetramethylcyclopropane-1-carboxamide

Drug info:

PubChemData

Smile

CCCCN(CCBr)C(=O)C1=CC=CC(=C1)C#N

DOS

IR

Vibrations