Geometry & MOs

Info

ID:	382294
PubChem CID:	134973359
Reduced:	OSC12H18 (1)
Stoich.:	ABC12D18 (1)
Weight, g/mol:	266.93535
ΔH_f, kcal/mol:	-65.66
Dipole, Da:	1.66
IP(EA), eV:	-8.77(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-2-phenyl-1,3-thiazole-5-carbaldehyde

Drug info:

PubChemData

Smile

CC1=CC[C@H]2[C@@H](C1)C(=O)CC(S2)(C)C

DOS

IR

Vibrations