Geometry & MOs

Info

ID:	259192
PubChem CID:	103158564
Reduced:	N2O4C13H24 (1)
Stoich.:	A2B4C13D24 (1)
Weight, g/mol:	258.157957
ΔH_f, kcal/mol:	-209.05
Dipole, Da:	2.3
IP(EA), eV:	-9.38(0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[cyclopentyl(methyl)carbamoyl]amino]-3-methoxybutanoic acid

Drug info:

PubChemData

Smile

CCC1CCCCN1C(=O)NCC(CC(=O)O)OC

DOS

IR

Vibrations