Geometry & MOs

Info

ID:	259128
PubChem CID:	103158292
Reduced:	NOC14H29 (1)
Stoich.:	ABC14D29 (1)
Weight, g/mol:	296.137222
ΔH_f, kcal/mol:	-102.87
Dipole, Da:	2.99
IP(EA), eV:	-8.96(2.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methoxy-4-[(2-methoxyphenyl)methylcarbamoylamino]butanoic acid

Drug info:

PubChemData

Smile

CC(C(C)(C)C)NCC(CC1CCCC1)O

DOS

IR

Vibrations