Geometry & MOs

Info

ID:	204623
PubChem CID:	79989294
Reduced:	NS2C11H19 (1)
Stoich.:	AB2C11D19 (1)
Weight, g/mol:	368.93403
ΔH_f, kcal/mol:	-2.99
Dipole, Da:	2.62
IP(EA), eV:	-8.73(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,4S)-1-(5-bromo-4-methylthiophen-2-yl)sulfonyl-4-hydroxypyrrolidine-2-carboxylic acid

Drug info:

PubChemData

Smile

CC1=C(SC=C1)C(CSCC(C)C)N

DOS

IR

Vibrations