Geometry & MOs

Info

ID:	208778
PubChem CID:	80584326
Reduced:	BrSN4C12H15 (1)
Stoich.:	ABC4D12E15 (1)
Weight, g/mol:	264.129634
ΔH_f, kcal/mol:	54.11
Dipole, Da:	7.45
IP(EA), eV:	-8.9(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-2-(thiolan-2-ylmethylamino)acetamide

Drug info:

PubChemData

Smile

C1CC(SC1)CNCC2=CN=C3N2C=C(N=C3)Br

DOS

IR

Vibrations