Geometry & MOs

Info

ID:	400819
PubChem CID:	135049167
Reduced:	BN2O2F4C22H29 (1)
Stoich.:	AB2C2D4E22F29 (1)
Weight, g/mol:	353.222903
ΔH_f, kcal/mol:	-307.09
Dipole, Da:	37.35
IP(EA), eV:	-8.9(-3.85)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

2-methoxy-5-[(3S,4R)-4-(4-methoxyphenyl)-3,4-dimethylhexan-3-yl]benzenediazonium

Drug info:

PubChemData

Smile

[B-](F)(F)(F)F.CC[C@](C)(C1=CC=C(C=C1)OC)[C@@](C)(CC)C2=CC(=C(C=C2)OC)[N+]#N

DOS

IR

Vibrations