Geometry & MOs

Info

ID:	258816
PubChem CID:	103157117
Reduced:	N2O4C13H24 (1)
Stoich.:	A2B4C13D24 (1)
Weight, g/mol:	260.173607
ΔH_f, kcal/mol:	-205.27
Dipole, Da:	7.37
IP(EA), eV:	-9.24(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(6-amino-4-methylhexanoyl)amino]-3-methoxybutanoic acid

Drug info:

PubChemData

Smile

COC(CC(=O)O)CNC(=O)CCC1CCCNC1

DOS

IR

Vibrations