Geometry & MOs

Info

ID:	328950
PubChem CID:	126729476
Reduced:	NC21H27 (1)
Stoich.:	AB21C27 (1)
Weight, g/mol:	304.063011
ΔH_f, kcal/mol:	108.22
Dipole, Da:	2.82
IP(EA), eV:	-8.88(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methoxy-2-(2-methoxyimidazo[2,1-b][1,3,4]thiadiazol-6-yl)-2,3-dihydro-1,3-benzoxazole

Drug info:

PubChemData

Smile

C/C=C/CC(C=N)/C(=C/C(=C\C)/C=C)/C=C/C=C/C(=C)C=C

DOS

IR

Vibrations