Geometry & MOs

Info

ID:	386800
PubChem CID:	134982969
Reduced:	SiO2C16H30 (1)
Stoich.:	AB2C16D30 (1)
Weight, g/mol:	253.18305
ΔH_f, kcal/mol:	-160.23
Dipole, Da:	2.29
IP(EA), eV:	-8.77(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

13-phenyl-13-azabicyclo[8.2.1]trideca-1(12),10-diene

Drug info:

PubChemData

Smile

CC1(CC(=C)/C(=C/CO[Si](C)(C)C(C)(C)C)/C1O)C

DOS

IR

Vibrations