Geometry & MOs

Info

ID:	212793
PubChem CID:	81061856
Reduced:	NO3C15H21 (1)
Stoich.:	AB3C15D21 (1)
Weight, g/mol:	288.168522
ΔH_f, kcal/mol:	-103.73
Dipole, Da:	6.97
IP(EA), eV:	-8.8(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[methyl-[methyl(2-propan-2-yloxyethyl)carbamoyl]amino]oxolane-3-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)OCCN(C)C1=CC=CC=C1/C=C/C(=O)O

DOS

IR

Vibrations