Geometry & MOs

Info

ID:	271167
PubChem CID:	103646036
Reduced:	BrSN4C10H11 (1)
Stoich.:	ABC4D10E11 (1)
Weight, g/mol:	185.141579
ΔH_f, kcal/mol:	66.7
Dipole, Da:	4.05
IP(EA), eV:	-9.19(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(cyclopentylamino)methyl]oxolan-3-ol

Drug info:

PubChemData

Smile

C1=C(SC(=C1)Br)CCNC2=NC=NC(=C2)N

DOS

IR

Vibrations