Geometry & MOs

Info

ID:	342316
PubChem CID:	127265093
Reduced:	N3O3C16H17 (1)
Stoich.:	A3B3C16D17 (1)
Weight, g/mol:	309.057198
ΔH_f, kcal/mol:	-61.46
Dipole, Da:	7.16
IP(EA), eV:	-9.19(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[2-(4-nitrophenyl)-2-pyridin-4-ylethenyl]-1,3-thiazole

Drug info:

PubChemData

Smile

CCN1C(=CC(=N1)C)C(=O)NC2=CC=C(C=C2)C=CC(=O)O

DOS

IR

Vibrations