Geometry & MOs

Info

ID:	379323
PubChem CID:	134358166
Reduced:	ClO2C11H13 (1)
Stoich.:	AB2C11D13 (1)
Weight, g/mol:	340.167459
ΔH_f, kcal/mol:	-94.18
Dipole, Da:	2.18
IP(EA), eV:	-9.66(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (E)-2-(4-methyl-2,3-dihydro-1H-inden-1-yl)-3-[(4-methyl-5-methylidene-2H-furan-2-yl)oxy]prop-2-enoate

Drug info:

PubChemData

Smile

CC(C1CC2=C(C1O)C=CC=C2Cl)O

DOS

IR

Vibrations