Geometry & MOs

Info

ID:	53676
PubChem CID:	14717719
Reduced:	SO8N9C33H47 (1)
Stoich.:	AB8C9D33E47 (1)
Weight, g/mol:	187.936708
ΔH_f, kcal/mol:	-309.3
Dipole, Da:	4.52
IP(EA), eV:	-8.76(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

sodium;trifluoromethyl sulfate

Drug info:

PubChemData

Smile

CSCCC(C(=O)NC(CCCN=C(N)N)C(=O)O)NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)CNC(=O)C(CC2=CC=C(C=C2)O)N

DOS

IR

Vibrations