Geometry & MOs

Info

ID:	379955
PubChem CID:	134964397
Reduced:	NOSiC16H21 (1)
Stoich.:	ABCD16E21 (1)
Weight, g/mol:	245.177964
ΔH_f, kcal/mol:	-16.68
Dipole, Da:	4.3
IP(EA), eV:	-8.25(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-ethyl-13,13-dimethyl-10-azatricyclo[7.3.1.02,7]trideca-2(7),3,5-trien-4-ol

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2C=C1[C@H](CC#C[Si](C)(C)C)O

DOS

IR

Vibrations