Geometry & MOs

Info

ID:	203559
PubChem CID:	79846100
Reduced:	NO4C15H19 (1)
Stoich.:	AB4C15D19 (1)
Weight, g/mol:	279.158292
ΔH_f, kcal/mol:	-161.73
Dipole, Da:	4.47
IP(EA), eV:	-9.04(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-[(2,5-diethylpyrazole-3-carbonyl)amino]cyclobutyl]acetic acid

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CC(=O)NC2(CCC2)CC(=O)O

DOS

IR

Vibrations