Geometry & MOs

Info

ID:	162158
PubChem CID:	57393793
Reduced:	FNO4C22H26 (1)
Stoich.:	ABC4D22E26 (1)
Weight, g/mol:	442.95668
ΔH_f, kcal/mol:	-170.15
Dipole, Da:	5.22
IP(EA), eV:	-8.98(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(Z)-[2-bromo-6-(4-nitrophenyl)imidazo[2,1-b][1,3]thiazol-5-yl]methylideneamino]guanidine;hydrochloride

Drug info:

PubChemData

Smile

C1COCCN1CC(COC2=CC=CC=C2C(=O)CCC3=CC=C(C=C3)F)O

DOS

IR

Vibrations