Geometry & MOs

Info

ID:	258785
PubChem CID:	103156993
Reduced:	NOC13H27 (1)
Stoich.:	ABC13D27 (1)
Weight, g/mol:	218.126657
ΔH_f, kcal/mol:	-97.21
Dipole, Da:	1.69
IP(EA), eV:	-9.02(2.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(3-amino-2-methylpropanoyl)amino]-3-methoxybutanoic acid

Drug info:

PubChemData

Smile

CCCC(C)NCC(CC1CCCC1)O

DOS

IR

Vibrations