Geometry & MOs

Info

ID:	163090
PubChem CID:	57638446
Reduced:	NO3C15H21 (1)
Stoich.:	AB3C15D21 (1)
Weight, g/mol:	220.084792
ΔH_f, kcal/mol:	-116.58
Dipole, Da:	5.17
IP(EA), eV:	-8.3(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(3-methylazetidine-1-carbonyl)pyridine-2-carboxylic acid

Drug info:

PubChemData

Smile

CCC1(CC(C(=O)NC1)OC2=CC=C(C=C2)OC)C

DOS

IR

Vibrations