Geometry & MOs

Info

ID:	259193
PubChem CID:	103158565
Reduced:	NO2C6H11 (2)
Stoich.:	AB2C6D11 (2)
Weight, g/mol:	246.157957
ΔH_f, kcal/mol:	-198.89
Dipole, Da:	2.82
IP(EA), eV:	-9.56(0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[ethyl(propyl)carbamoyl]amino]-3-methoxybutanoic acid

Drug info:

PubChemData

Smile

CN(C1CCCC1)C(=O)NCC(CC(=O)O)OC

DOS

IR

Vibrations