Geometry & MOs

Info

ID:	148586
PubChem CID:	53788254
Reduced:	O15C38H50 (1)
Stoich.:	A15B38C50 (1)
Weight, g/mol:	151.020418
ΔH_f, kcal/mol:	-635.55
Dipole, Da:	5.14
IP(EA), eV:	-10.39(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1H-imidazol-2-yl)-1,2-thiazole

Drug info:

PubChemData

Smile

CC(C)C12COC(=O)C=CC1C3(CCC4C(C3C(C2OC(=O)C)OC(=O)C)(C(C(C5(C4(CC(=O)C6C5(O6)C(=O)OC)O)C)OC(=O)C)OC(=O)C)C)C

DOS

IR

Vibrations