Geometry & MOs

Info

ID:	380546
PubChem CID:	134971027
Reduced:	OSiC23H26 (1)
Stoich.:	ABC23D26 (1)
Weight, g/mol:	259.193614
ΔH_f, kcal/mol:	44.76
Dipole, Da:	2.8
IP(EA), eV:	-9.07(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,12R)-16,16-dimethyl-7-azatricyclo[10.4.0.03,8]hexadeca-3(8),4,6-trien-12-ol

Drug info:

PubChemData

Smile

CC#CC(C#CC[Si](C1=CC=CC=C1)(C2=CC=CC=C2)C(C)(C)C)O

DOS

IR

Vibrations