Geometry & MOs

Info

ID:	149803
PubChem CID:	53789480
Reduced:	SN4O8C27H34 (1)
Stoich.:	AB4C8D27E34 (1)
Weight, g/mol:	320.086449
ΔH_f, kcal/mol:	-187.06
Dipole, Da:	3.87
IP(EA), eV:	-8.93(-1.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

prop-2-enyl 2-[3-(methanesulfonamido)prop-1-enyl]-4-sulfanylpyrrolidine-1-carboxylate

Drug info:

PubChemData

Smile

C[C@@H]1C2C(C(=O)N2C(=C1SC3C[C@H](N(C3)C)C(C4CN(C4)C)O)C(=O)OC(=O)C5=CC=C(C=C5)[N+](=O)[O-])C(C)O

DOS

IR

Vibrations