Geometry & MOs

Info

ID:	183732
PubChem CID:	77063416
Reduced:	OSN2C14H22 (1)
Stoich.:	ABC2D14E22 (1)
Weight, g/mol:	243.115381
ΔH_f, kcal/mol:	-4.28
Dipole, Da:	1.79
IP(EA), eV:	-8.64(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-hydroxy-2,2-dimethyl-5-(1H-1,2,4-triazol-5-ylsulfanyl)pentanimidamide

Drug info:

PubChemData

Smile

CC(C)(CCCSCC1=CC=CC=C1)C(=NO)N

DOS

IR

Vibrations