Geometry & MOs

Info

ID:	227855
PubChem CID:	87562723
Reduced:	O3N6C19H26 (1)
Stoich.:	A3B6C19D26 (1)
Weight, g/mol:	475.928484
ΔH_f, kcal/mol:	-69.35
Dipole, Da:	5.6
IP(EA), eV:	-8.76(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

sulfo hydrogen sulfate;sulfurochloridic acid;triethyl phosphate

Drug info:

PubChemData

Smile

C[C@H](CC(C)C)N(C1=NC(=NC=C1C(=O)N)NC2=CC(=CC=C2)NC(=O)C)O

DOS

IR

Vibrations