Geometry & MOs

Info

ID:	50898
PubChem CID:	12013489
Reduced:	ON2C16H16 (1)
Stoich.:	AB2C16D16 (1)
Weight, g/mol:	252.89248
ΔH_f, kcal/mol:	1.8
Dipole, Da:	0.91
IP(EA), eV:	-8.98(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-3-(bromomethyl)cyclobutane-1-carbonitrile

Drug info:

PubChemData

Smile

C1CCCC2=NC3=C4C(=CC=C3)NC(=O)C4=C2CC1

DOS

IR

Vibrations