Geometry & MOs

Info

ID:	394006
PubChem CID:	135022154
Reduced:	SiO5C27H34 (1)
Stoich.:	AB5C27D34 (1)
Weight, g/mol:	386.04765
ΔH_f, kcal/mol:	-211.98
Dipole, Da:	4.16
IP(EA), eV:	-8.89(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (E)-3-(2,4-dichlorophenyl)-2-(naphthalen-2-yloxymethyl)prop-2-enoate

Drug info:

PubChemData

Smile

CC1(O[C@@H]2[C@H](O1)O[C@H]([C@@]23C=CCO3)CO[Si](C4=CC=CC=C4)(C5=CC=CC=C5)C(C)(C)C)C

DOS

IR

Vibrations