Geometry & MOs

Info

ID:	43033
PubChem CID:	10317938
Reduced:	NO4C23H31 (1)
Stoich.:	AB4C23D31 (1)
Weight, g/mol:	385.20732
ΔH_f, kcal/mol:	-151.13
Dipole, Da:	2.92
IP(EA), eV:	-7.98(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[2-[benzyl(trimethylsilylmethyl)amino]ethyl]-4-oxocyclohexa-2,5-dien-1-yl]methyl acetate

Drug info:

PubChemData

Smile

CC1=C(C2=C(CCC(O2)(C)CNCC3=CC(=C(C=C3)OC)OC)C(=C1O)C)C

DOS

IR

Vibrations