Geometry & MOs

Info

ID:	28241
PubChem CID:	826476
Reduced:	S2N3C10H11 (1)
Stoich.:	A2B3C10D11 (1)
Weight, g/mol:	250.100066
ΔH_f, kcal/mol:	49.59
Dipole, Da:	3.93
IP(EA), eV:	-8.29(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-hydrazinyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)hydrazine

Drug info:

PubChemData

Smile

CSC1=NC(=C2C3=C(CCC3)SC2=N1)N

DOS

IR

Vibrations