Geometry & MOs

Info

ID:	127677
PubChem CID:	51010914
Reduced:	N2O3F4C25H28 (1)
Stoich.:	A2B3C4D25E28 (1)
Weight, g/mol:	338.217826
ΔH_f, kcal/mol:	-270.75
Dipole, Da:	3.85
IP(EA), eV:	-8.68(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(Z)-2-[(1S,2R,6S,7R)-10,10-dimethyl-7-phenyl-8,9-diazatricyclo[5.2.1.02,6]dec-8-en-1-yl]ethenyl]-trimethylsilane

Drug info:

PubChemData

Smile

C1CC1OC2=C(C=C(C=C2)OC(F)(F)F)CN[C@H]3[C@H](C[C@@H]4[C@H](C[C@]3(N4)C5=CC=CC=C5)CO)F

DOS

IR

Vibrations