Geometry & MOs

Info

ID:	400761
PubChem CID:	135049020
Reduced:	BNF3C7H7 (1)
Stoich.:	ABC3D7E7 (1)
Weight, g/mol:	356.263509
ΔH_f, kcal/mol:	-243.26
Dipole, Da:	8.88
IP(EA), eV:	-10.52(-1.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

phenyl 3-bis[di(propan-2-yl)amino]boranylprop-2-ynoate

Drug info:

PubChemData

Smile

[B-]([N+]1=CC=CC=C1C=C)(F)(F)F

DOS

IR

Vibrations