Geometry & MOs

Info

ID:	253166
PubChem CID:	103116454
Reduced:	NOC5H5 (3)
Stoich.:	ABC5D5 (3)
Weight, g/mol:	287.126991
ΔH_f, kcal/mol:	-59.73
Dipole, Da:	12.33
IP(EA), eV:	-8.95(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1-methylindazole-3-carbonyl)amino]cyclopentane-1-carboxylic acid

Drug info:

PubChemData

Smile

CN1C=CC(=N1)C(=O)N2CCCC3=C2C=CC(=C3)C(=O)O

DOS

IR

Vibrations