Geometry & MOs

Info

ID:	327247
PubChem CID:	126689329
Reduced:	F3O3N4C25H27 (1)
Stoich.:	A3B3C4D25E27 (1)
Weight, g/mol:	203.97623
ΔH_f, kcal/mol:	-231.85
Dipole, Da:	8.59
IP(EA), eV:	-8.99(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-sulfinooxypropyl hydrogen sulfite

Drug info:

PubChemData

Smile

CC1([C@H](CN(C1=O)C)C2=CC3=C(C=C2)N(C(=N3)NC(=O)C4=CC(=CC=C4)C(F)(F)F)CCCO)C

DOS

IR

Vibrations