Geometry & MOs

Info

ID:	194090
PubChem CID:	78480143
Reduced:	ClFNSO3H17C18 (1)
Stoich.:	ABCDE3F17G18 (1)
Weight, g/mol:	170.069142
ΔH_f, kcal/mol:	-152.78
Dipole, Da:	8.41
IP(EA), eV:	-9.05(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-aminoacetyl)-2,5-dihydropyrrole-2-carboxylic acid

Drug info:

PubChemData

Smile

CC1CCC2=C(C1)C=C(S2)C(=O)OCC(=O)NC3=CC(=C(C=C3)F)Cl

DOS

IR

Vibrations