Geometry & MOs

Info

ID:	342334
PubChem CID:	127265152
Reduced:	N2H7C9 (2)
Stoich.:	A2B7C9 (2)
Weight, g/mol:	295.077933
ΔH_f, kcal/mol:	137.5
Dipole, Da:	3.17
IP(EA), eV:	-9.4(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-methoxyphenyl)-4-(2-pyrimidin-4-ylethenyl)-1,3-thiazole

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)C=CC2=NC=NC=C2)C=CC3=NC=NC=C3

DOS

IR

Vibrations