Geometry & MOs

Info

ID:	385272
PubChem CID:	134978662
Reduced:	BN3C6H10 (1)
Stoich.:	AB3C6D10 (1)
Weight, g/mol:	176.173631
ΔH_f, kcal/mol:	12.81
Dipole, Da:	6.93
IP(EA), eV:	-10.57(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-propyl-1-boratricyclo[3.3.1.13,7]decane

Drug info:

PubChemData

Smile

B(C#N)(C#N)N(CC)CC

DOS

IR

Vibrations