Geometry & MOs

Info

ID:	202301
PubChem CID:	79654216
Reduced:	OSF2N2C14H18 (1)
Stoich.:	ABC2D2E14F18 (1)
Weight, g/mol:	245.029269
ΔH_f, kcal/mol:	-127.64
Dipole, Da:	2.6
IP(EA), eV:	-9.17(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-amino-3-(1,3,4-thiadiazol-2-ylsulfanyl)cyclopentane-1-carboxylic acid

Drug info:

PubChemData

Smile

CCNC1(CCC(C1)SC2=CC(=C(C=C2)F)F)C(=O)N

DOS

IR

Vibrations