Geometry & MOs

Info

ID:	28104
PubChem CID:	825582
Reduced:	BrOSN2C9H11 (1)
Stoich.:	ABCD2E9F11 (1)
Weight, g/mol:	273.97755
ΔH_f, kcal/mol:	-10.59
Dipole, Da:	2.35
IP(EA), eV:	-8.77(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6S)-6-(bromomethyl)-4-methyl-2-methylsulfanyl-5,6-dihydrofuro[2,3-d]pyrimidine

Drug info:

PubChemData

Smile

CC1=C2C[C@@H](OC2=NC(=N1)SC)CBr

DOS

IR

Vibrations