Geometry & MOs

Info

ID:	132778
PubChem CID:	51419502
Reduced:	OSN4C19H26 (1)
Stoich.:	ABC4D19E26 (1)
Weight, g/mol:	371.0978
ΔH_f, kcal/mol:	-4.79
Dipole, Da:	6.19
IP(EA), eV:	-8.99(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

(Z)-[[amino-[(3S)-2,5-dioxo-1-phenylpyrrolidin-3-yl]sulfanylmethylidene]amino]-[(2-fluorophenyl)methylidene]azanium

Drug info:

PubChemData

Smile

C[C@@H]1CCC[C@H]([C@H]1C)NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C

DOS

IR

Vibrations