Geometry & MOs

Info

ID:	426823
PubChem CID:	135154083
Reduced:	ON3C11H17 (1)
Stoich.:	AB3C11D17 (1)
Weight, g/mol:	333.071802
ΔH_f, kcal/mol:	-28.78
Dipole, Da:	1.7
IP(EA), eV:	-9.06(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(N-cyano-S-propan-2-ylsulfinimidoyl)phenyl]-4-methylthiadiazole-5-carboxamide

Drug info:

PubChemData

Smile

CC1=CN=C(N=C1N2CCC(CC2)O)C

DOS

IR

Vibrations