Geometry & MOs

Info

ID:	211736
PubChem CID:	81051749
Reduced:	SO2N3C13H15 (1)
Stoich.:	AB2C3D13E15 (1)
Weight, g/mol:	335.00918
ΔH_f, kcal/mol:	-49.08
Dipole, Da:	4.65
IP(EA), eV:	-9.26(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-bromophenyl)sulfanyl-2,6-dimethylpyridine-3-carboximidamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=N1)C)C(=O)O)NCC2=CN=C(S2)C

DOS

IR

Vibrations