Geometry & MOs

Info

ID:	313541
PubChem CID:	126615724
Reduced:	N3O3C11H13 (1)
Stoich.:	A3B3C11D13 (1)
Weight, g/mol:	235.095691
ΔH_f, kcal/mol:	-85.05
Dipole, Da:	3.77
IP(EA), eV:	-9.39(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(6-methylpyridin-2-yl)carbamoyl]azetidine-1-carboxylic acid

Drug info:

PubChemData

Smile

CC1=NC(=CC=C1)NC(=O)[C@@H]2CCN2C(=O)O

DOS

IR

Vibrations