Geometry & MOs

Info

ID:	183310
PubChem CID:	77005868
Reduced:	NO3C9H15 (1)
Stoich.:	AB3C9D15 (1)
Weight, g/mol:	242.199428
ΔH_f, kcal/mol:	-124.54
Dipole, Da:	5.24
IP(EA), eV:	-9.24(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(dimethylamino)ethyl-(2-methylpropyl)amino]-3-methylbut-2-enoic acid

Drug info:

PubChemData

Smile

CC(=CC(=O)O)CN1CCOCC1

DOS

IR

Vibrations