Geometry & MOs

Info

ID:	398012
PubChem CID:	135031354
Reduced:	OC5H5 (4)
Stoich.:	AB5C5 (4)
Weight, g/mol:	386.145285
ΔH_f, kcal/mol:	-101.66
Dipole, Da:	4.72
IP(EA), eV:	-8.39(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,3-dibenzyl-4-(4-methoxyphenyl)-1,3-thiazol-2-imine

Drug info:

PubChemData

Smile

CCC1=CC(=CC2=C1OC(=C2)C3=C(C=C(C=C3)O)OC)/C=C/CO

DOS

IR

Vibrations