Geometry & MOs

Info

ID:	296389
PubChem CID:	117571740
Reduced:	BrN2C13H15 (1)
Stoich.:	AB2C13D15 (1)
Weight, g/mol:	211.110947
ΔH_f, kcal/mol:	45.09
Dipole, Da:	4.32
IP(EA), eV:	-8.56(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1-cyanocyclobutyl)methylamino]benzonitrile

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)NCC2(CCC2)C#N)Br

DOS

IR

Vibrations