Geometry & MOs

Info

ID:	45665
PubChem CID:	10516226
Reduced:	NC9H13 (2)
Stoich.:	AB9C13 (2)
Weight, g/mol:	270.165121
ΔH_f, kcal/mol:	19.97
Dipole, Da:	2.24
IP(EA), eV:	-7.92(0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5R)-5-[tert-butyl(dimethyl)silyl]oxy-3-methoxy-5-methylcyclohex-2-en-1-one

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)N(CC2CN3CCCCC3)CC=C

DOS

IR

Vibrations