Geometry & MOs

Info

ID:	262041
PubChem CID:	103267120
Reduced:	NO2C9H13 (1)
Stoich.:	AB2C9D13 (1)
Weight, g/mol:	213.136493
ΔH_f, kcal/mol:	-31.51
Dipole, Da:	4.43
IP(EA), eV:	-9.7(0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]-3-methylbut-2-enoic acid

Drug info:

PubChemData

Smile

CC(C#C)NC1CCC1C(=O)O

DOS

IR

Vibrations