Geometry & MOs

Info

ID:	194743
PubChem CID:	78583882
Reduced:	F2S2N4C19H24 (1)
Stoich.:	A2B2C4D19E24 (1)
Weight, g/mol:	348.093249
ΔH_f, kcal/mol:	-44.11
Dipole, Da:	5.69
IP(EA), eV:	-8.3(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]ethenyl]benzonitrile

Drug info:

PubChemData

Smile

CC1=CC(=C(N1CC(C)C)C)C=NNC(=S)NC2=CC=C(C=C2)SC(F)F

DOS

IR

Vibrations