Geometry & MOs

Info

ID:	433986
PubChem CID:	135174136
Reduced:	ON3C24H27 (1)
Stoich.:	AB3C24D27 (1)
Weight, g/mol:	252.91707
ΔH_f, kcal/mol:	62.15
Dipole, Da:	2.22
IP(EA), eV:	-9.02(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-1-iodopyrimidine-2-thione

Drug info:

PubChemData

Smile

C=CCOC1=CC(=CC(=C1)/C=C/C2=CC=C(C=C2)C#N)CNCC3CCNC3

DOS

IR

Vibrations