Geometry & MOs

Info

ID:	259140
PubChem CID:	103158345
Reduced:	NOC14H27 (1)
Stoich.:	ABC14D27 (1)
Weight, g/mol:	296.137222
ΔH_f, kcal/mol:	-82.52
Dipole, Da:	2.8
IP(EA), eV:	-8.98(2.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methoxy-4-[(4-methoxyphenyl)methylcarbamoylamino]butanoic acid

Drug info:

PubChemData

Smile

CCC1(CCC1)NCC(CC2CCCC2)O

DOS

IR

Vibrations