Geometry & MOs

Info

ID:	259173
PubChem CID:	103158481
Reduced:	ON2C13H24 (1)
Stoich.:	AB2C13D24 (1)
Weight, g/mol:	287.184506
ΔH_f, kcal/mol:	-54.55
Dipole, Da:	4.7
IP(EA), eV:	-9.11(1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(1-ethylpyrrolidin-2-yl)methylcarbamoylamino]-3-methoxybutanoic acid

Drug info:

PubChemData

Smile

CC(CC#N)N(C)CC(CC1CCCC1)O

DOS

IR

Vibrations