Geometry & MOs

Info

ID:	407363
PubChem CID:	135079941
Reduced:	ON2C12H14 (1)
Stoich.:	AB2C12D14 (1)
Weight, g/mol:	475.179501
ΔH_f, kcal/mol:	18.34
Dipole, Da:	6.18
IP(EA), eV:	-8.35(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (Z)-3-(3,4-dimethoxyphenyl)-3-[3-[[(1R)-7-fluoro-2,3-dihydro-1H-inden-1-yl]iminomethyl]phenoxy]prop-2-enoate

Drug info:

PubChemData

Smile

CC(=C)CN1C=NC2=C1C=CC(=C2)OC

DOS

IR

Vibrations