Geometry & MOs

Info

ID:	185829
PubChem CID:	77356320
Reduced:	SiN3O7C29H47 (1)
Stoich.:	AB3C7D29E47 (1)
Weight, g/mol:	597.320271
ΔH_f, kcal/mol:	-329.55
Dipole, Da:	3.58
IP(EA), eV:	-9.08(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl 2-[2-[4-[3,3-diethyl-1-[1-(4-methylphenyl)but-3-enylcarbamoyl]-4-oxoazetidin-2-yl]oxyphenyl]ethylamino]acetate

Drug info:

PubChemData

Smile

CC(C1C(NC1=O)CC(=O)C(=CC2CC(CN2C(=O)OCC=C)N(C)C(=O)OCC=C)C)O[Si](C)(C)C(C)(C)C

DOS

IR

Vibrations