Geometry & MOs

Info

ID:	401847
PubChem CID:	135052943
Reduced:	SO3H14C17 (1)
Stoich.:	AB3C14D17 (1)
Weight, g/mol:	254.178299
ΔH_f, kcal/mol:	-32.47
Dipole, Da:	7.7
IP(EA), eV:	-8.44(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclohexyl-N,N-dimethyl-N'-phenylprop-2-ynimidamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2=CC(=S)C3=C(O2)C=CC(=C3)OC

DOS

IR

Vibrations