Geometry & MOs

Info

ID:	402694
PubChem CID:	135056922
Reduced:	ClOSN2C11H13 (1)
Stoich.:	ABCD2E11F13 (1)
Weight, g/mol:	211.9352
ΔH_f, kcal/mol:	-6.31
Dipole, Da:	5.52
IP(EA), eV:	-8.87(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-bromo-1,2-oxazol-5-yl)methylazanium;chloride

Drug info:

PubChemData

Smile

C/C(=N\SC(=O)N(C)C)/C1=CC=C(C=C1)Cl

DOS

IR

Vibrations