Geometry & MOs

Info

ID:	207280
PubChem CID:	80371328
Reduced:	O4N5C11H17 (1)
Stoich.:	A4B5C11D17 (1)
Weight, g/mol:	266.101505
ΔH_f, kcal/mol:	-147.69
Dipole, Da:	6.24
IP(EA), eV:	-10.09(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-(5-cyclopropyl-1H-1,2,4-triazole-3-carbonyl)-4-hydroxypyrrolidine-2-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)C1=NC(=NN1)C(=O)NC(CCC(=O)N)C(=O)O

DOS

IR

Vibrations