Geometry & MOs

Info

ID:	401152
PubChem CID:	135050349
Reduced:	LiOSC8H9 (1)
Stoich.:	ABCD8E9 (1)
Weight, g/mol:	451.251129
ΔH_f, kcal/mol:	-32.59
Dipole, Da:	3.19
IP(EA), eV:	-7.31(0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(E)-2-methylpent-2-enyl] N-[1-(2-methoxynaphthalen-1-yl)-3-methylnaphthalen-2-yl]propanimidate

Drug info:

PubChemData

Smile

[Li+].CS(=O)[CH-]C1=CC=CC=C1

DOS

IR

Vibrations