Geometry & MOs

Info

ID:	146684
PubChem CID:	53730768
Reduced:	N9H19C21 (1)
Stoich.:	A9B19C21 (1)
Weight, g/mol:	364.330131
ΔH_f, kcal/mol:	151.65
Dipole, Da:	6.36
IP(EA), eV:	-8.71(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

hex-1-enyl-bis(4,6,6-trimethyl-3-bicyclo[3.1.1]hept-2-enyl)borane

Drug info:

PubChemData

Smile

CC1=C(NC(=C1)C2=NC3=C(N2)C=C(C=C3)C(=N)N)C4=NC5=C(N4)C=C(C=C5)C(=N)N

DOS

IR

Vibrations