Geometry & MOs

Info

ID:	200495
PubChem CID:	79400015
Reduced:	BrOSN2C12H13 (1)
Stoich.:	ABCD2E12F13 (1)
Weight, g/mol:	304.92922
ΔH_f, kcal/mol:	14.93
Dipole, Da:	1.95
IP(EA), eV:	-8.85(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[(4-bromo-1,3-thiazol-2-yl)sulfanyl]-3-methylimidazol-4-yl]methanol

Drug info:

PubChemData

Smile

CN(CC1=CC(=CC=C1)OC)C2=NC(=CS2)Br

DOS

IR

Vibrations