Geometry & MOs

Info

ID:	289418
PubChem CID:	104352131
Reduced:	N3O4C13H21 (1)
Stoich.:	A3B4C13D21 (1)
Weight, g/mol:	295.128054
ΔH_f, kcal/mol:	-199.02
Dipole, Da:	6.93
IP(EA), eV:	-9.83(0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[(3-acetamidopyrrolidine-1-carbonyl)amino]pyrazol-1-yl]acetic acid

Drug info:

PubChemData

Smile

CC(=O)NC1CCN(C1)C(=O)NC2CCC(C2)C(=O)O

DOS

IR

Vibrations