Geometry & MOs

Info

ID:	219886
PubChem CID:	85165008
Reduced:	N6O7C31H44 (1)
Stoich.:	A6B7C31D44 (1)
Weight, g/mol:	612.366219
ΔH_f, kcal/mol:	-296.57
Dipole, Da:	10.18
IP(EA), eV:	-8.76(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-[3-ethyl-6-methoxy-4,5-bis(phenylmethoxy)oxan-2-yl]-6-methoxy-8-(methoxymethoxy)-5,7-dimethylnon-3-en-2-one

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC(CC1=CN=CN1C)C(=O)N2CCCC2C(=O)NC(C)(C)C(=O)NC(CC3=CC=CC=C3)C(=O)OC

DOS

IR

Vibrations